| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 48.4 | Very low | 84.2 | Confident | 237 Ų | 237 | 86.1 Ų | 86.1 | 100% | 1.167 | 47% | 0.468 | S | S | * | . | 0 | 126.5 | 0 | -70.8 | -73.5 | -178.8 | 0 | 0 | 106.9 | |||||
| 2 | L | 68.6 | Low | 85.2 | Confident | 110 Ų | 110 | 84.7 Ų | 84.7 | 58% | 0.576 | 46% | 0.459 | S | S | * | . | trans | -69.6 | 141.8 | 168.2 | -83.6 | 74.1 | 0 | 0 | 0 | 108.4 | I7 I10 | L2-I7 HydrophobicContact CB-CD1 4.3Å; L2-I7 HydrophobicContact CB-CG1 3.93Å; L2-I7 HydrophobicContact CD2-CG1 4.25Å; L2-I10 HydrophobicContact CD2-CD1 3.65Å | ||
| 3 | T | 81.3 | Confident | 86.1 | Confident | 75 Ų | 75 | 78.2 Ų | 78.2 | 46% | 0.46 | 42% | 0.424 | S | S | . | . | trans | -74.6 | 159.8 | 172.2 | 64.6 | 0 | 0 | 0 | 0 | 110.2 | E5 S6 I7 | T3-E5 PolarHBondContact O-N 3.22Å; T3-S6 PolarHBondContact O-N 3.04Å; T3-S6 PolarHBondContact OG1-N 3.48Å; T3-S6 VanDerWaalsContact OG1-N 3.12Å; T3-S6 PolarHBondContact OG1-OG 3.22Å; T3-S6 VanDerWaalsContact OG1-OG 3.1Å; T3-I7 WeakPolarHBondContact O-CG1 3.39Å; T3-I7 PolarHBondContact O-N 2.91Å | ||
| 4 | S | 85.4 | Confident | 86.9 | Confident | 97 Ų | 97 | 79.1 Ų | 79.1 | 68% | 0.678 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -56.2 | -37.3 | 171.9 | 44.2 | 0 | 0 | 0 | 0 | 112.1 | I7 L8 | S4-I7 PolarHBondContact O-N 2.77Å; S4-L8 WeakPolarHBondContact O-CB 3.47Å; S4-L8 PolarHBondContact O-N 3.15Å |
| 5 | E | 84.8 | Confident | 87.6 | Confident | 98 Ų | 98 | 79.8 Ų | 79.8 | 46% | 0.458 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -63.1 | -46.2 | 175.1 | -59.8 | -174 | 162.3 | 0 | 0 | 112.2 | T3 I7 L8 Y9 | T3-E5 PolarHBondContact O-N 3.22Å; E5-I7 PolarHBondContact O-N 2.65Å; E5-L8 PolarHBondContact O-N 3.09Å; E5-Y9 WeakPolarHBondContact O-CB 3.47Å; E5-Y9 PolarHBondContact O-N 2.9Å |
| 6 | S | 87.3 | Confident | 88.2 | Confident | 23 Ų | 23 | 76.2 Ų | 76.2 | 16% | 0.161 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -65.3 | -37.4 | 176.6 | -60.1 | 0 | 0 | 0 | 0 | 112.4 | T3 Y9 I10 | T3-S6 PolarHBondContact O-N 3.04Å; T3-S6 PolarHBondContact OG1-N 3.48Å; T3-S6 VanDerWaalsContact OG1-N 3.12Å; T3-S6 PolarHBondContact OG1-OG 3.22Å; T3-S6 VanDerWaalsContact OG1-OG 3.1Å; S6-Y9 PolarHBondContact O-N 3.27Å; S6-I10 WeakPolarHBondContact O-CD1 3.47Å; S6-I10 WeakPolarHBondContact O-CG1 3.28Å; S6-I10 PolarHBondContact O-N 3.42Å |
| 7 | I | 91.3 | Very high | 88.8 | Confident | 88 Ų | 88 | 72.3 Ų | 72.3 | 45% | 0.451 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -64.2 | -45.6 | 175.3 | -65.9 | 167.8 | 0 | 0 | 0 | 110.2 | L2 T3 S4 E5 I10 V11 | L2-I7 HydrophobicContact CB-CD1 4.3Å; L2-I7 HydrophobicContact CB-CG1 3.93Å; L2-I7 HydrophobicContact CD2-CG1 4.25Å; T3-I7 WeakPolarHBondContact O-CG1 3.39Å; T3-I7 PolarHBondContact O-N 2.91Å; S4-I7 PolarHBondContact O-N 2.77Å; E5-I7 PolarHBondContact O-N 2.65Å; I7-I10 PolarHBondContact O-N 3.14Å; I7-V11 WeakPolarHBondContact O-CG2 3.33Å; I7-V11 PolarHBondContact O-N 2.88Å |
| 8 | L | 93.8 | Very high | 89.3 | Confident | 105 Ų | 105 | 72.8 Ų | 72.8 | 55% | 0.55 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.5 | -44.8 | 177.2 | 179.9 | 61.6 | 0 | 0 | 0 | 111.7 | S4 E5 V11 L12 | S4-L8 WeakPolarHBondContact O-CB 3.47Å; S4-L8 PolarHBondContact O-N 3.15Å; E5-L8 PolarHBondContact O-N 3.09Å; L8-V11 PolarHBondContact O-N 3.37Å; L8-L12 HydrophobicContact CD1-CD1 3.98Å; L8-L12 HydrophobicContact CD1-CG 4.13Å; L8-L12 HydrophobicContact CG-CD1 3.96Å; L8-L12 HydrophobicContact CG-CG 4.49Å; L8-L12 WeakPolarHBondContact O-CB 3.49Å; L8-L12 VanDerWaalsContact O-CG 3.31Å; L8-L12 WeakPolarHBondContact O-CG 3.42Å; L8-L12 PolarHBondContact O-N 3.33Å |
| 9 | Y | 94.3 | Very high | 89.7 | Confident | 6 Ų | 6 | 74.9 Ų | 74.9 | 2% | 0.024 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -54.6 | -52.7 | 174.4 | 169.4 | -107.2 | 0 | 0 | 0 | 111.5 | E5 S6 V11 L12 E13 I64 Y272 I275 I276 | E5-Y9 WeakPolarHBondContact O-CB 3.47Å; E5-Y9 PolarHBondContact O-N 2.9Å; S6-Y9 PolarHBondContact O-N 3.27Å; Y9-V11 PolarHBondContact O-N 2.85Å; Y9-L12 PolarHBondContact O-N 3.01Å; Y9-E13 HydrophobicContact CD2-CG 3.95Å; Y9-E13 HydrophobicContact CE1-CG 4.2Å; Y9-E13 HydrophobicContact CE2-CG 3.48Å; Y9-E13 VanDerWaalsContact CE2-CG 3.48Å; Y9-E13 VanDerWaalsContact CE2-OE1 3.24Å; Y9-E13 WeakPolarHBondContact CE2-OE1 3.4Å; Y9-E13 HydrophobicContact CG-CG 4.47Å; Y9-E13 WeakPolarHBondContact O-CB 3.45Å; Y9-E13 WeakPolarHBondContact O-CG 3.21Å; Y9-E13 PolarHBondContact O-N 3.19Å; Y9-E13 PolarHBondContact OH-OE1 2.92Å; Y9-I64 HydrophobicContact CE1-CG1 4.49Å; Y9-Y272 HydrophobicContact CD1-CD1 4.23Å; Y9-Y272 HydrophobicContact CD1-CE1 4.11Å; Y9-Y272 AromaticContact CD2-CD1 3.76Å; Y9-Y272 HydrophobicContact CD2-CD1 3.76Å; Y9-Y272 HydrophobicContact CD2-CD2 4.3Å; Y9-Y272 HydrophobicContact CD2-CE1 4.46Å; Y9-Y272 AromaticContact CD2-CG 3.67Å; Y9-Y272 HydrophobicContact CD2-CG 3.67Å; Y9-Y272 HydrophobicContact CE1-CD1 4.38Å; Y9-Y272 HydrophobicContact CE1-CE1 4.27Å; Y9-Y272 AromaticContact CE2-CD1 3.95Å; Y9-Y272 HydrophobicContact CE2-CD1 3.95Å; Y9-Y272 HydrophobicContact CE2-CG 4.28Å; Y9-Y272 AromaticContact CG-CD1 3.94Å; Y9-Y272 HydrophobicContact CG-CD1 3.94Å; Y9-Y272 HydrophobicContact CG-CD2 4.06Å; Y9-Y272 HydrophobicContact CG-CE1 4.22Å; Y9-Y272 HydrophobicContact CG-CE2 4.33Å; Y9-Y272 AromaticContact CG-CG 3.85Å; Y9-Y272 HydrophobicContact CG-CG 3.85Å; Y9-I275 HydrophobicContact CE2-CG2 4.34Å; Y9-I276 HydrophobicContact CD2-CD1 3.77Å; Y9-I276 HydrophobicContact CD2-CG1 3.91Å; Y9-I276 HydrophobicContact CE2-CD1 4.38Å; Y9-I276 HydrophobicContact CE2-CG1 4.01Å |
| 10 | I | 95.1 | Very high | 90.1 | Very high | 34 Ų | 34 | 71.2 Ų | 71.2 | 17% | 0.174 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -60.5 | -43.5 | -179.6 | -68 | 167.5 | 0 | 0 | 0 | 111.7 | L2 S6 I7 L14 I64 | L2-I10 HydrophobicContact CD2-CD1 3.65Å; S6-I10 WeakPolarHBondContact O-CD1 3.47Å; S6-I10 WeakPolarHBondContact O-CG1 3.28Å; S6-I10 PolarHBondContact O-N 3.42Å; I7-I10 PolarHBondContact O-N 3.14Å; I10-L14 HydrophobicContact CG2-CD1 3.88Å; I10-L14 HydrophobicContact CG2-CG 4.38Å; I10-L14 WeakPolarHBondContact O-CB 3.41Å; I10-L14 VanDerWaalsContact O-CG 3.25Å; I10-L14 WeakPolarHBondContact O-CG 3.42Å; I10-L14 PolarHBondContact O-N 3.28Å; I10-I64 HydrophobicContact CD1-CG2 4.37Å; I10-I64 HydrophobicContact CG1-CG2 3.99Å; I10-I64 HydrophobicContact CG2-CD1 4.44Å; I10-I64 HydrophobicContact CG2-CG2 4.44Å |
| 11 | V | 96 | Very high | 90.5 | Very high | 74 Ų | 74 | 69.5 Ų | 69.5 | 45% | 0.448 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -64.5 | -43.2 | 179 | 170.8 | 0 | 0 | 0 | 0 | 111.4 | I7 L8 Y9 L14 L15 | I7-V11 WeakPolarHBondContact O-CG2 3.33Å; I7-V11 PolarHBondContact O-N 2.88Å; L8-V11 PolarHBondContact O-N 3.37Å; Y9-V11 PolarHBondContact O-N 2.85Å; V11-L14 PolarHBondContact O-N 3.36Å; V11-L15 HydrophobicContact CG1-CD1 4.23Å; V11-L15 VanDerWaalsContact O-CG 3.31Å; V11-L15 WeakPolarHBondContact O-CG 3.4Å; V11-L15 PolarHBondContact O-N 2.87Å; V11-L15 VanDerWaalsContact O-N 3.07Å |
| 12 | L | 96.4 | Very high | 92.8 | Very high | 69 Ų | 69 | 63.5 Ų | 63.5 | 36% | 0.361 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -66.1 | -43.4 | 178.2 | -69.9 | 173.4 | 0 | 0 | 0 | 112 | L8 Y9 L15 I16 I276 | L8-L12 HydrophobicContact CD1-CD1 3.98Å; L8-L12 HydrophobicContact CD1-CG 4.13Å; L8-L12 HydrophobicContact CG-CD1 3.96Å; L8-L12 HydrophobicContact CG-CG 4.49Å; L8-L12 WeakPolarHBondContact O-CB 3.49Å; L8-L12 VanDerWaalsContact O-CG 3.31Å; L8-L12 WeakPolarHBondContact O-CG 3.42Å; L8-L12 PolarHBondContact O-N 3.33Å; Y9-L12 PolarHBondContact O-N 3.01Å; L12-L15 PolarHBondContact O-N 2.93Å; L12-I16 WeakPolarHBondContact O-CG1 3.25Å; L12-I16 PolarHBondContact O-N 3.24Å; L12-I276 HydrophobicContact CB-CD1 3.96Å; L12-I276 HydrophobicContact CD1-CD1 3.92Å |
| 13 | E | 96.4 | Very high | 94.2 | Very high | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.1 | -46.2 | 174.8 | -77 | -71.3 | -174.8 | 0 | 0 | 112.1 | Y9 L15 I16 A17 I60 I64 I275 I276 H279 | Y9-E13 HydrophobicContact CD2-CG 3.95Å; Y9-E13 HydrophobicContact CE1-CG 4.2Å; Y9-E13 HydrophobicContact CE2-CG 3.48Å; Y9-E13 VanDerWaalsContact CE2-CG 3.48Å; Y9-E13 VanDerWaalsContact CE2-OE1 3.24Å; Y9-E13 WeakPolarHBondContact CE2-OE1 3.4Å; Y9-E13 HydrophobicContact CG-CG 4.47Å; Y9-E13 WeakPolarHBondContact O-CB 3.45Å; Y9-E13 WeakPolarHBondContact O-CG 3.21Å; Y9-E13 PolarHBondContact O-N 3.19Å; Y9-E13 PolarHBondContact OH-OE1 2.92Å; E13-L15 VanDerWaalsContact C-N 3.32Å; E13-L15 PolarHBondContact O-N 3.12Å; E13-I16 PolarHBondContact O-N 3.48Å; E13-I16 VanDerWaalsContact O-N 3.16Å; E13-A17 WeakPolarHBondContact O-CB 3.47Å; E13-A17 PolarHBondContact O-N 2.82Å; E13-I60 HydrophobicContact CB-CG2 3.8Å; E13-I60 WeakPolarHBondContact OE2-CG2 3.41Å; E13-I64 HydrophobicContact CB-CD1 3.88Å; E13-I64 HydrophobicContact CB-CG1 4.06Å; E13-I64 HydrophobicContact CG-CG1 4.46Å; E13-I275 WeakPolarHBondContact OE1-CG2 3.41Å; E13-I276 HydrophobicContact CG-CG1 4.22Å; E13-H279 VanDerWaalsContact CD-ND1 3.28Å; E13-H279 IonicContact OE1-CE1 3.59Å; E13-H279 IonicContact OE1-ND1 2.87Å; E13-H279 PolarHBondContact OE1-ND1 3.35Å; E13-H279 IonicContact OE2-CE1 3.81Å; E13-H279 IonicContact OE2-CG 2.71Å; E13-H279 IonicContact OE2-ND1 2.94Å; E13-H279 PolarHBondContact OE2-ND1 3.18Å |
| 14 | L | 97.2 | Very high | 94.9 | Very high | 92 Ų | 92 | 55.4 Ų | 55.4 | 48% | 0.482 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -62.6 | -37.1 | 176.8 | -72 | 173.2 | 0 | 0 | 0 | 112.5 | I10 V11 A17 V18 I64 | I10-L14 HydrophobicContact CG2-CD1 3.88Å; I10-L14 HydrophobicContact CG2-CG 4.38Å; I10-L14 WeakPolarHBondContact O-CB 3.41Å; I10-L14 VanDerWaalsContact O-CG 3.25Å; I10-L14 WeakPolarHBondContact O-CG 3.42Å; I10-L14 PolarHBondContact O-N 3.28Å; V11-L14 PolarHBondContact O-N 3.36Å; L14-A17 PolarHBondContact O-N 2.94Å; L14-V18 WeakPolarHBondContact O-CG2 3.41Å; L14-V18 PolarHBondContact O-N 3.11Å; L14-I64 HydrophobicContact CD2-CD1 4.03Å; L14-I64 HydrophobicContact CG-CD1 4.07Å |
| 15 | L | 97.6 | Very high | 95.5 | Very high | 89 Ų | 89 | 54 Ų | 54 | 47% | 0.466 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -64.2 | -44.9 | 172.9 | -71.8 | 169.4 | 0 | 0 | 0 | 111.3 | V11 L12 E13 A17 V18 F19 | V11-L15 HydrophobicContact CG1-CD1 4.23Å; V11-L15 VanDerWaalsContact O-CG 3.31Å; V11-L15 WeakPolarHBondContact O-CG 3.4Å; V11-L15 PolarHBondContact O-N 2.87Å; V11-L15 VanDerWaalsContact O-N 3.07Å; L12-L15 PolarHBondContact O-N 2.93Å; E13-L15 VanDerWaalsContact C-N 3.32Å; E13-L15 PolarHBondContact O-N 3.12Å; L15-A17 PolarHBondContact O-N 3.09Å; L15-V18 PolarHBondContact O-N 3.13Å; L15-F19 WeakPolarHBondContact O-CD2 3.4Å; L15-F19 PolarHBondContact O-N 3.03Å |
| 16 | I | 97.5 | Very high | 96.1 | Very high | 22 Ų | 22 | 50.9 Ų | 50.9 | 11% | 0.113 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -61 | -43.5 | 176.3 | -71.4 | 172.2 | 0 | 0 | 0 | 110.9 | L12 E13 V18 F19 S20 I60 I276 H279 A280 V283 | L12-I16 WeakPolarHBondContact O-CG1 3.25Å; L12-I16 PolarHBondContact O-N 3.24Å; E13-I16 PolarHBondContact O-N 3.48Å; E13-I16 VanDerWaalsContact O-N 3.16Å; I16-V18 PolarHBondContact O-N 3.17Å; I16-F19 PolarHBondContact O-N 3.34Å; I16-S20 VanDerWaalsContact O-CB 3.28Å; I16-S20 WeakPolarHBondContact O-CB 3.39Å; I16-S20 PolarHBondContact O-N 3.03Å; I16-I60 HydrophobicContact CB-CD1 4.34Å; I16-I60 HydrophobicContact CG2-CD1 3.7Å; I16-I276 HydrophobicContact CD1-CG2 3.71Å; I16-H279 HydrophobicContact CG2-CB 3.98Å; I16-A280 HydrophobicContact CD1-CB 4.3Å; I16-V283 HydrophobicContact CB-CG2 4.33Å; I16-V283 HydrophobicContact CG2-CG2 3.74Å; I16-V283 VanDerWaalsContact O-CG2 3.32Å; I16-V283 WeakPolarHBondContact O-CG2 3.23Å |
| 17 | A | 98 | Very high | 96.5 | Very high | 10 Ų | 10 | 49.8 Ų | 49.8 | 8% | 0.083 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -57.4 | -50.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | E13 L14 L15 F19 S20 V21 G56 I60 | E13-A17 WeakPolarHBondContact O-CB 3.47Å; E13-A17 PolarHBondContact O-N 2.82Å; L14-A17 PolarHBondContact O-N 2.94Å; L15-A17 PolarHBondContact O-N 3.09Å; A17-F19 PolarHBondContact O-N 3.16Å; A17-S20 PolarHBondContact O-N 2.9Å; A17-V21 WeakPolarHBondContact O-CG2 3.41Å; A17-V21 PolarHBondContact O-N 2.88Å; A17-G56 WeakPolarHBondContact CB-O 3.46Å; A17-I60 HydrophobicContact CB-CB 4.23Å; A17-I60 HydrophobicContact CB-CD1 3.94Å; A17-I60 HydrophobicContact CB-CG2 3.99Å |
| 18 | V | 98 | Very high | 96.8 | Very high | 81 Ų | 81 | 46.6 Ų | 46.6 | 49% | 0.491 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -60.2 | -48.2 | 178.2 | 170.3 | 0 | 0 | 0 | 0 | 111.3 | L14 L15 I16 S20 V21 L22 | L14-V18 WeakPolarHBondContact O-CG2 3.41Å; L14-V18 PolarHBondContact O-N 3.11Å; L15-V18 PolarHBondContact O-N 3.13Å; I16-V18 PolarHBondContact O-N 3.17Å; V18-S20 PolarHBondContact O-N 3.12Å; V18-V21 PolarHBondContact O-N 2.87Å; V18-L22 HydrophobicContact CG1-CD1 3.74Å; V18-L22 HydrophobicContact CG1-CG 4.36Å; V18-L22 WeakPolarHBondContact O-CB 3.39Å; V18-L22 VanDerWaalsContact O-CG 3.29Å; V18-L22 WeakPolarHBondContact O-CG 3.32Å; V18-L22 PolarHBondContact O-N 2.8Å |
| 19 | F | 97.6 | Very high | 96.9 | Very high | 113 Ų | 113 | 46.3 Ų | 46.3 | 50% | 0.496 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -66.6 | -35.7 | 179.1 | -74.6 | -61 | 0 | 0 | 0 | 113 | L15 I16 A17 G23 V283 | L15-F19 WeakPolarHBondContact O-CD2 3.4Å; L15-F19 PolarHBondContact O-N 3.03Å; I16-F19 PolarHBondContact O-N 3.34Å; A17-F19 PolarHBondContact O-N 3.16Å; F19-G23 PolarHBondContact O-N 2.96Å; F19-V283 HydrophobicContact CB-CG1 3.77Å; F19-V283 HydrophobicContact CB-CG2 4.01Å |
| 20 | S | 97.2 | Very high | 96.9 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -64.4 | -49.3 | 177.1 | -172.8 | 0 | 0 | 0 | 0 | 110.8 | I16 A17 V18 N24 D52 S282 | I16-S20 VanDerWaalsContact O-CB 3.28Å; I16-S20 WeakPolarHBondContact O-CB 3.39Å; I16-S20 PolarHBondContact O-N 3.03Å; A17-S20 PolarHBondContact O-N 2.9Å; V18-S20 PolarHBondContact O-N 3.12Å; S20-N24 VanDerWaalsContact O-CB 3.3Å; S20-N24 WeakPolarHBondContact O-CB 3.4Å; S20-N24 PolarHBondContact O-N 3.37Å; S20-N24 PolarHBondContact O-ND2 2.7Å; S20-D52 PolarHBondContact OG-O 3.16Å; S20-S282 WeakPolarHBondContact OG-CB 3.25Å |
| 21 | V | 98.3 | Very high | 97 | Very high | 37 Ų | 37 | 44.8 Ų | 44.8 | 22% | 0.224 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -63 | -52.8 | 179.5 | 175.4 | 0 | 0 | 0 | 0 | 110.8 | A17 V18 G23 N24 V25 V57 | A17-V21 WeakPolarHBondContact O-CG2 3.41Å; A17-V21 PolarHBondContact O-N 2.88Å; V18-V21 PolarHBondContact O-N 2.87Å; V21-G23 PolarHBondContact O-N 3.17Å; V21-N24 PolarHBondContact O-N 3.49Å; V21-V25 HydrophobicContact CG1-CG2 4.19Å; V21-V25 VanDerWaalsContact O-CB 3.26Å; V21-V25 WeakPolarHBondContact O-CB 3.4Å; V21-V25 WeakPolarHBondContact O-CG2 3.43Å; V21-V25 PolarHBondContact O-N 3.37Å; V21-V57 HydrophobicContact CG2-CG2 3.67Å |
| 22 | L | 97.3 | Very high | 96.9 | Very high | 111 Ų | 111 | 45.7 Ų | 45.7 | 58% | 0.581 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -61.7 | -43.8 | -178.3 | -67.8 | 177.5 | 0 | 0 | 0 | 112.2 | V18 L26 | V18-L22 HydrophobicContact CG1-CD1 3.74Å; V18-L22 HydrophobicContact CG1-CG 4.36Å; V18-L22 WeakPolarHBondContact O-CB 3.39Å; V18-L22 VanDerWaalsContact O-CG 3.29Å; V18-L22 WeakPolarHBondContact O-CG 3.32Å; V18-L22 PolarHBondContact O-N 2.8Å; L22-L26 WeakPolarHBondContact O-CB 3.43Å; L22-L26 PolarHBondContact O-N 2.96Å; L22-L26 VanDerWaalsContact O-N 3.14Å |
| 23 | G | 96.8 | Very high | 96.7 | Very high | 15 Ų | 15 | 47 Ų | 47 | 16% | 0.155 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -65 | -46.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | F19 V21 L26 V27 P286 | F19-G23 PolarHBondContact O-N 2.96Å; V21-G23 PolarHBondContact O-N 3.17Å; G23-L26 WeakPolarHBondContact O-CB 3.48Å; G23-L26 PolarHBondContact O-N 3.13Å; G23-V27 WeakPolarHBondContact O-CG2 3.32Å; G23-V27 PolarHBondContact O-N 3.45Å; G23-V27 VanDerWaalsContact O-N 3.1Å; G23-P286 WeakPolarHBondContact O-CG 3.2Å |
| 24 | N | 97.6 | Very high | 96.5 | Very high | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -80.8 | -29.3 | -176.2 | -70.8 | -66.6 | 0 | 0 | 0 | 113.1 | S20 V21 L26 V27 C28 A49 D52 I53 S282 P286 | S20-N24 VanDerWaalsContact O-CB 3.3Å; S20-N24 WeakPolarHBondContact O-CB 3.4Å; S20-N24 PolarHBondContact O-N 3.37Å; S20-N24 PolarHBondContact O-ND2 2.7Å; V21-N24 PolarHBondContact O-N 3.49Å; N24-L26 VanDerWaalsContact C-N 3.28Å; N24-L26 PolarHBondContact O-N 2.88Å; N24-V27 WeakPolarHBondContact O-CB 3.16Å; N24-V27 PolarHBondContact O-N 3.19Å; N24-C28 PolarHBondContact O-N 2.99Å; N24-C28 PolarHBondContact O-SG 2.9Å; N24-A49 HydrophobicContact CB-CB 3.99Å; N24-D52 HydrophobicContact CB-CB 4.34Å; N24-D52 WeakPolarHBondContact ND2-CB 3.44Å; N24-I53 HydrophobicContact CB-CD1 4.21Å; N24-I53 HydrophobicContact CB-CG1 3.67Å; N24-S282 PolarHBondContact ND2-O 3.49Å; N24-P286 WeakPolarHBondContact OD1-CD 3.3Å; N24-P286 WeakPolarHBondContact OD1-CG 3.2Å |
| 25 | V | 97.8 | Very high | 96.2 | Very high | 68 Ų | 68 | 48.2 Ų | 48.2 | 41% | 0.412 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -59.7 | -41.2 | 165.4 | 168.3 | 0 | 0 | 0 | 0 | 110.4 | V21 V27 C28 W29 I53 | V21-V25 HydrophobicContact CG1-CG2 4.19Å; V21-V25 VanDerWaalsContact O-CB 3.26Å; V21-V25 WeakPolarHBondContact O-CB 3.4Å; V21-V25 WeakPolarHBondContact O-CG2 3.43Å; V21-V25 PolarHBondContact O-N 3.37Å; V25-V27 VanDerWaalsContact C-N 3.35Å; V25-V27 PolarHBondContact O-N 3.19Å; V25-C28 PolarHBondContact O-N 3.27Å; V25-W29 VanDerWaalsContact O-CB 3.32Å; V25-W29 WeakPolarHBondContact O-CB 3.26Å; V25-W29 PolarHBondContact O-N 3.39Å; V25-I53 HydrophobicContact CG2-CD1 3.75Å; V25-I53 HydrophobicContact CG2-CG1 4.14Å |
| 26 | L | 96.3 | Very high | 95.8 | Very high | 31 Ų | 31 | 50 Ų | 50 | 16% | 0.162 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -64.9 | -35.3 | 175.5 | -176.4 | 65.8 | 0 | 0 | 0 | 112.6 | L22 G23 N24 A30 F300 I303 I304 | L22-L26 WeakPolarHBondContact O-CB 3.43Å; L22-L26 PolarHBondContact O-N 2.96Å; L22-L26 VanDerWaalsContact O-N 3.14Å; G23-L26 WeakPolarHBondContact O-CB 3.48Å; G23-L26 PolarHBondContact O-N 3.13Å; N24-L26 VanDerWaalsContact C-N 3.28Å; N24-L26 PolarHBondContact O-N 2.88Å; L26-A30 VanDerWaalsContact O-CB 3.32Å; L26-A30 WeakPolarHBondContact O-CB 3.47Å; L26-A30 PolarHBondContact O-N 2.77Å; L26-F300 HydrophobicContact CD1-CD1 4.17Å; L26-F300 HydrophobicContact CD2-CB 4.21Å; L26-F300 HydrophobicContact CD2-CD1 3.94Å; L26-F300 HydrophobicContact CD2-CD2 4.24Å; L26-F300 HydrophobicContact CD2-CE1 4.33Å; L26-F300 HydrophobicContact CD2-CG 3.89Å; L26-F300 HydrophobicContact CG-CD1 3.64Å; L26-F300 HydrophobicContact CG-CE1 3.83Å; L26-F300 HydrophobicContact CG-CG 4.14Å; L26-F300 HydrophobicContact CG-CZ 4.46Å; L26-F300 WeakPolarHBondContact O-CE1 3.41Å; L26-I303 HydrophobicContact CD1-CB 4.01Å; L26-I303 HydrophobicContact CD1-CD1 3.8Å; L26-I303 HydrophobicContact CD1-CG2 3.66Å; L26-I304 HydrophobicContact CD2-CD1 4.41Å |
| 27 | V | 96.8 | Very high | 95.4 | Very high | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.3 | -54.2 | 171.8 | 173.5 | 0 | 0 | 0 | 0 | 110.7 | G23 N24 V25 W29 A30 V31 V45 A49 P286 Y289 F296 F300 | G23-V27 WeakPolarHBondContact O-CG2 3.32Å; G23-V27 PolarHBondContact O-N 3.45Å; G23-V27 VanDerWaalsContact O-N 3.1Å; N24-V27 WeakPolarHBondContact O-CB 3.16Å; N24-V27 PolarHBondContact O-N 3.19Å; V25-V27 VanDerWaalsContact C-N 3.35Å; V25-V27 PolarHBondContact O-N 3.19Å; V27-W29 PolarHBondContact O-N 3.33Å; V27-A30 PolarHBondContact O-N 3.36Å; V27-V31 PolarHBondContact O-N 3.01Å; V27-V45 HydrophobicContact CG1-CG1 3.82Å; V27-A49 HydrophobicContact CB-CB 4.16Å; V27-A49 HydrophobicContact CG1-CB 3.94Å; V27-P286 HydrophobicContact CG2-CB 4.06Å; V27-P286 HydrophobicContact CG2-CG 3.93Å; V27-Y289 HydrophobicContact CG1-CD2 4.29Å; V27-Y289 HydrophobicContact CG1-CE2 4.28Å; V27-Y289 HydrophobicContact CG2-CD2 3.79Å; V27-Y289 HydrophobicContact CG2-CE2 4.18Å; V27-F296 HydrophobicContact CG1-CE1 4.15Å; V27-F296 HydrophobicContact CG1-CZ 4.49Å; V27-F300 HydrophobicContact CG2-CZ 3.94Å |
| 28 | C | 97.2 | Very high | 95 | Very high | 22 Ų | 22 | 53.5 Ų | 53.5 | 15% | 0.149 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -57.2 | -48.6 | 178 | -68.7 | 0 | 0 | 0 | 0 | 111.4 | N24 V25 A30 V31 C32 | N24-C28 PolarHBondContact O-N 2.99Å; N24-C28 PolarHBondContact O-SG 2.9Å; V25-C28 PolarHBondContact O-N 3.27Å; C28-A30 VanDerWaalsContact C-N 3.32Å; C28-A30 PolarHBondContact O-N 3Å; C28-V31 PolarHBondContact O-N 3.4Å; C28-C32 PolarHBondContact O-N 3.34Å; C28-C32 PolarHBondContact O-SG 3.42Å; C28-C32 VanDerWaalsContact O-SG 3.33Å |
| 29 | W | 95.7 | Very high | 94.6 | Very high | 99 Ų | 99 | 52 Ų | 52 | 38% | 0.375 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -61.2 | -38.5 | -179.6 | -166.5 | 9.9 | 0 | 0 | 0 | 112.4 | V25 V27 C32 L33 I303 H307 | V25-W29 VanDerWaalsContact O-CB 3.32Å; V25-W29 WeakPolarHBondContact O-CB 3.26Å; V25-W29 PolarHBondContact O-N 3.39Å; V27-W29 PolarHBondContact O-N 3.33Å; W29-C32 PolarHBondContact O-N 2.97Å; W29-L33 HydrophobicContact CD2-CD1 4.5Å; W29-L33 HydrophobicContact CG-CD1 4.22Å; W29-L33 VanDerWaalsContact NE1-CD1 3.32Å; W29-L33 WeakPolarHBondContact O-CB 3.19Å; W29-L33 WeakPolarHBondContact O-CG 3.26Å; W29-L33 PolarHBondContact O-N 3.5Å; W29-I303 HydrophobicContact CD2-CD1 4.46Å; W29-I303 HydrophobicContact CD2-CG2 4.07Å; W29-I303 HydrophobicContact CE3-CG2 3.63Å; W29-I303 HydrophobicContact CG-CD1 4.33Å; W29-I303 HydrophobicContact CH2-CG2 3.98Å; W29-I303 HydrophobicContact CZ2-CG2 4.37Å; W29-I303 HydrophobicContact CZ3-CG2 3.59Å; W29-H307 HydrophobicContact CH2-CB 3.73Å; W29-H307 AromaticContact CH2-CG 3.87Å; W29-H307 HydrophobicContact CZ2-CB 4.34Å; W29-H307 AromaticContact CZ2-CD2 3.89Å; W29-H307 AromaticContact CZ2-CG 3.96Å |
| 30 | A | 95.3 | Very high | 94.2 | Very high | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -65.4 | -38.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | L26 V27 C28 N34 L37 F296 T299 F300 I303 | L26-A30 VanDerWaalsContact O-CB 3.32Å; L26-A30 WeakPolarHBondContact O-CB 3.47Å; L26-A30 PolarHBondContact O-N 2.77Å; V27-A30 PolarHBondContact O-N 3.36Å; C28-A30 VanDerWaalsContact C-N 3.32Å; C28-A30 PolarHBondContact O-N 3Å; A30-N34 WeakPolarHBondContact O-CB 3.41Å; A30-N34 PolarHBondContact O-N 3.14Å; A30-L37 HydrophobicContact CB-CD1 4.21Å; A30-F296 HydrophobicContact CB-CD1 4.09Å; A30-F296 HydrophobicContact CB-CE1 4.21Å; A30-T299 HydrophobicContact CB-CG2 3.69Å; A30-F300 HydrophobicContact CB-CD1 3.78Å; A30-F300 HydrophobicContact CB-CE1 3.56Å; A30-I303 HydrophobicContact CB-CD1 4.03Å |
| 31 | V | 95.4 | Very high | 93.7 | Very high | 7 Ų | 7 | 48.9 Ų | 48.9 | 4% | 0.042 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -69.5 | -39.9 | 175.2 | 178 | 0 | 0 | 0 | 0 | 110.9 | V27 C28 L37 Q38 N42 V46 F296 | V27-V31 PolarHBondContact O-N 3.01Å; C28-V31 PolarHBondContact O-N 3.4Å; V31-L37 HydrophobicContact CG2-CB 4.41Å; V31-Q38 HydrophobicContact CG1-CG 4.39Å; V31-Q38 WeakPolarHBondContact O-CG 3.33Å; V31-Q38 PolarHBondContact O-NE2 2.91Å; V31-Q38 VanDerWaalsContact O-NE2 3.09Å; V31-N42 HydrophobicContact CG1-CB 4.49Å; V31-N42 HydrophobicContact CG2-CB 4.37Å; V31-V46 HydrophobicContact CB-CG2 3.88Å; V31-V46 HydrophobicContact CG1-CG2 3.88Å; V31-V46 HydrophobicContact CG2-CG2 3.92Å; V31-F296 HydrophobicContact CG2-CE1 3.78Å; V31-F296 HydrophobicContact CG2-CZ 3.66Å |
| 32 | C | 93.7 | Very high | 93.5 | Very high | 94 Ų | 94 | 47.9 Ų | 47.9 | 64% | 0.635 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -63.6 | -41 | 175.2 | -67.2 | 0 | 0 | 0 | 0 | 112.8 | C28 W29 Q38 | C28-C32 PolarHBondContact O-N 3.34Å; C28-C32 PolarHBondContact O-SG 3.42Å; C28-C32 VanDerWaalsContact O-SG 3.33Å; W29-C32 PolarHBondContact O-N 2.97Å; C32-Q38 PolarHBondContact O-NE2 3.14Å; C32-Q38 VanDerWaalsContact O-NE2 3.12Å |
| 33 | L | 92.5 | Very high | 93.3 | Very high | 96 Ų | 96 | 45.2 Ų | 45.2 | 50% | 0.503 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -78.2 | -29.9 | -176.4 | -79.2 | 175.4 | 0 | 0 | 0 | 115.2 | W29 I303 | W29-L33 HydrophobicContact CD2-CD1 4.5Å; W29-L33 HydrophobicContact CG-CD1 4.22Å; W29-L33 VanDerWaalsContact NE1-CD1 3.32Å; W29-L33 WeakPolarHBondContact O-CB 3.19Å; W29-L33 WeakPolarHBondContact O-CG 3.26Å; W29-L33 PolarHBondContact O-N 3.5Å; L33-I303 HydrophobicContact CD1-CD1 3.85Å; L33-I303 HydrophobicContact CD1-CG1 3.66Å |
| 34 | N | 92.5 | Very high | 93.1 | Very high | 31 Ų | 31 | 45 Ų | 45 | 17% | 0.166 | 25% | 0.248 | C | C | . | . | trans | -116.4 | 107.6 | -169.8 | -173.4 | -0.8 | 0 | 0 | 0 | 110.9 | A30 N36 L37 Q38 T299 | A30-N34 WeakPolarHBondContact O-CB 3.41Å; A30-N34 PolarHBondContact O-N 3.14Å; N34-N36 PolarHBondContact O-N 3.15Å; N34-N36 VanDerWaalsContact O-N 3.13Å; N34-N36 WeakPolarHBondContact OD1-CB 3.19Å; N34-N36 PolarHBondContact OD1-N 3.24Å; N34-N36 VanDerWaalsContact OD1-N 3.11Å; N34-N36 PolarHBondContact OD1-ND2 3.1Å; N34-L37 HydrophobicContact CB-CB 4.34Å; N34-L37 HydrophobicContact CB-CD1 4.14Å; N34-L37 HydrophobicContact CB-CG 4.24Å; N34-L37 WeakPolarHBondContact O-CA 3.46Å; N34-L37 WeakPolarHBondContact O-CB 3.47Å; N34-L37 PolarHBondContact O-N 3.02Å; N34-Q38 PolarHBondContact O-N 3.34Å; N34-T299 HydrophobicContact CB-CG2 4.02Å; N34-T299 PolarHBondContact ND2-OG1 3.48Å | ||
| 35 | S | 90.8 | Very high | 93 | Very high | 87 Ų | 87 | 45.3 Ų | 45.3 | 61% | 0.608 | 25% | 0.249 | S | C | * | . | G | 310 helix | trans | -55.7 | -29.5 | 176.4 | 53.1 | 0 | 0 | 0 | 0 | 113.5 | L37 Q38 | S35-L37 PolarHBondContact O-N 2.92Å; S35-Q38 PolarHBondContact O-N 3Å |
| 36 | N | 89.3 | Confident | 92.9 | Very high | 126 Ų | 126 | 43.9 Ų | 43.9 | 67% | 0.674 | 24% | 0.241 | S | C | * | . | G | 310 helix | trans | -67.6 | -16.7 | 174 | -54.9 | -84.3 | 0 | 0 | 0 | 113.3 | N34 | N34-N36 PolarHBondContact O-N 3.15Å; N34-N36 VanDerWaalsContact O-N 3.13Å; N34-N36 WeakPolarHBondContact OD1-CB 3.19Å; N34-N36 PolarHBondContact OD1-N 3.24Å; N34-N36 VanDerWaalsContact OD1-N 3.11Å; N34-N36 PolarHBondContact OD1-ND2 3.1Å |
| 37 | L | 90.1 | Very high | 92.8 | Very high | 4 Ų | 4 | 42.8 Ų | 42.8 | 2% | 0.021 | 24% | 0.236 | C | C | . | . | G | 310 helix | trans | -97.4 | -2.1 | 172.3 | -68.4 | 177.2 | 0 | 0 | 0 | 112.6 | A30 V31 N34 S35 S39 N42 E295 F296 T299 | A30-L37 HydrophobicContact CB-CD1 4.21Å; V31-L37 HydrophobicContact CG2-CB 4.41Å; N34-L37 HydrophobicContact CB-CB 4.34Å; N34-L37 HydrophobicContact CB-CD1 4.14Å; N34-L37 HydrophobicContact CB-CG 4.24Å; N34-L37 WeakPolarHBondContact O-CA 3.46Å; N34-L37 WeakPolarHBondContact O-CB 3.47Å; N34-L37 PolarHBondContact O-N 3.02Å; S35-L37 PolarHBondContact O-N 2.92Å; L37-S39 PolarHBondContact O-N 3.27Å; L37-N42 WeakPolarHBondContact O-CB 3.26Å; L37-N42 PolarHBondContact O-ND2 2.9Å; L37-E295 HydrophobicContact CD2-CB 3.67Å; L37-E295 HydrophobicContact CG-CB 4.41Å; L37-F296 HydrophobicContact CD1-CD1 3.91Å; L37-F296 HydrophobicContact CD1-CE1 4.05Å; L37-F296 HydrophobicContact CD1-CG 4.18Å; L37-F296 HydrophobicContact CD1-CZ 4.44Å; L37-F296 HydrophobicContact CD2-CD2 3.88Å; L37-F296 HydrophobicContact CD2-CE2 3.94Å; L37-F296 HydrophobicContact CD2-CG 4.25Å; L37-F296 HydrophobicContact CD2-CZ 4.36Å; L37-T299 HydrophobicContact CD1-CG2 4.36Å |
| 38 | Q | 90.1 | Very high | 92.8 | Very high | 102 Ų | 102 | 42.8 Ų | 42.8 | 48% | 0.477 | 24% | 0.236 | S | C | . | . | trans | -85.7 | 49.4 | 179 | -65.1 | 176.2 | -0.3 | 0 | 0 | 111.7 | V31 C32 N34 S35 | V31-Q38 HydrophobicContact CG1-CG 4.39Å; V31-Q38 WeakPolarHBondContact O-CG 3.33Å; V31-Q38 PolarHBondContact O-NE2 2.91Å; V31-Q38 VanDerWaalsContact O-NE2 3.09Å; C32-Q38 PolarHBondContact O-NE2 3.14Å; C32-Q38 VanDerWaalsContact O-NE2 3.12Å; N34-Q38 PolarHBondContact O-N 3.34Å; S35-Q38 PolarHBondContact O-N 3Å | ||
| 39 | S | 89.4 | Confident | 92.7 | Very high | 48 Ų | 48 | 41.8 Ų | 41.8 | 34% | 0.336 | 23% | 0.229 | S | C | . | . | trans | -88.5 | 160.3 | 173.3 | 70.6 | 0 | 0 | 0 | 0 | 111.4 | L37 T41 N42 F43 | L37-S39 PolarHBondContact O-N 3.27Å; S39-T41 VanDerWaalsContact C-N 3.34Å; S39-T41 PolarHBondContact O-N 3.04Å; S39-N42 PolarHBondContact O-N 3.3Å; S39-N42 PolarHBondContact OG-ND2 3.36Å; S39-F43 PolarHBondContact O-N 3.49Å | ||
| 40 | I | 88.3 | Confident | 92.8 | Very high | 34 Ų | 34 | 40.2 Ų | 40.2 | 17% | 0.174 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -63.2 | -40.7 | -176.7 | -55.8 | 170.1 | 0 | 0 | 0 | 111.4 | N42 F43 V116 A121 | I40-N42 PolarHBondContact O-N 3.46Å; I40-F43 HydrophobicContact CG2-CD2 4.45Å; I40-F43 WeakPolarHBondContact O-CB 3.19Å; I40-F43 PolarHBondContact O-N 3.01Å; I40-F43 VanDerWaalsContact O-N 3.1Å; I40-V116 HydrophobicContact CB-CG1 4.05Å; I40-V116 HydrophobicContact CD1-CG1 4.08Å; I40-V116 WeakPolarHBondContact CD1-O 3.33Å; I40-V116 HydrophobicContact CG2-CG1 3.59Å; I40-A121 HydrophobicContact CG2-CB 3.4Å; I40-A121 VanDerWaalsContact CG2-CB 3.4Å |
| 41 | T | 87.7 | Confident | 92.9 | Very high | 15 Ų | 15 | 40.2 Ų | 40.2 | 9% | 0.092 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -51.8 | -40.8 | 171.2 | -46.5 | 0 | 0 | 0 | 0 | 112.4 | S39 F43 F44 V45 D101 R102 | S39-T41 VanDerWaalsContact C-N 3.34Å; S39-T41 PolarHBondContact O-N 3.04Å; T41-F43 VanDerWaalsContact C-N 3.28Å; T41-F43 PolarHBondContact O-N 3.47Å; T41-F44 PolarHBondContact O-N 3.2Å; T41-F44 VanDerWaalsContact O-N 3.16Å; T41-V45 PolarHBondContact O-N 3.1Å; T41-D101 WeakPolarHBondContact CB-OD2 3.35Å; T41-D101 WeakPolarHBondContact CG2-OD2 3.46Å; T41-D101 PolarHBondContact OG1-OD2 2.85Å; T41-R102 PolarHBondContact OG1-NH2 3.39Å |
| 42 | N | 92.4 | Very high | 93 | Very high | 16 Ų | 16 | 39.9 Ų | 39.9 | 9% | 0.086 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -76.4 | -13.4 | -175.6 | -70.3 | -11.6 | 0 | 0 | 0 | 113 | V31 L37 S39 I40 V45 V46 | V31-N42 HydrophobicContact CG1-CB 4.49Å; V31-N42 HydrophobicContact CG2-CB 4.37Å; L37-N42 WeakPolarHBondContact O-CB 3.26Å; L37-N42 PolarHBondContact O-ND2 2.9Å; S39-N42 PolarHBondContact O-N 3.3Å; S39-N42 PolarHBondContact OG-ND2 3.36Å; I40-N42 PolarHBondContact O-N 3.46Å; N42-V45 PolarHBondContact O-N 3.44Å; N42-V46 WeakPolarHBondContact O-CG2 3.37Å; N42-V46 PolarHBondContact O-N 3.48Å |
| 43 | F | 93.4 | Very high | 93.2 | Very high | 54 Ų | 54 | 37.2 Ų | 37.2 | 24% | 0.237 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -66.6 | -37.4 | 166 | -63 | -40.7 | 0 | 0 | 0 | 111.9 | S39 I40 T41 V46 S47 I125 | S39-F43 PolarHBondContact O-N 3.49Å; I40-F43 HydrophobicContact CG2-CD2 4.45Å; I40-F43 WeakPolarHBondContact O-CB 3.19Å; I40-F43 PolarHBondContact O-N 3.01Å; I40-F43 VanDerWaalsContact O-N 3.1Å; T41-F43 VanDerWaalsContact C-N 3.28Å; T41-F43 PolarHBondContact O-N 3.47Å; F43-V46 PolarHBondContact O-N 3.46Å; F43-S47 PolarHBondContact O-N 3.3Å; F43-I125 HydrophobicContact CB-CD1 3.91Å |
| 44 | F | 93.8 | Very high | 93.4 | Very high | 12 Ų | 12 | 33.4 Ų | 33.4 | 5% | 0.053 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -68.4 | -36.8 | 172.7 | -61 | -71.4 | 0 | 0 | 0 | 111.7 | T41 V46 S47 L48 A97 I98 A121 T124 I125 | T41-F44 PolarHBondContact O-N 3.2Å; T41-F44 VanDerWaalsContact O-N 3.16Å; F44-V46 VanDerWaalsContact C-N 3.34Å; F44-S47 WeakPolarHBondContact O-CB 3.31Å; F44-S47 PolarHBondContact O-N 3.46Å; F44-L48 PolarHBondContact O-N 2.9Å; F44-A97 HydrophobicContact CD1-CB 3.68Å; F44-A97 HydrophobicContact CE1-CB 3.73Å; F44-A97 HydrophobicContact CG-CB 4.2Å; F44-A97 HydrophobicContact CZ-CB 4.29Å; F44-I98 HydrophobicContact CB-CD1 4.18Å; F44-I98 HydrophobicContact CB-CG1 3.62Å; F44-A121 HydrophobicContact CE2-CB 4.05Å; F44-A121 HydrophobicContact CZ-CB 3.85Å; F44-T124 HydrophobicContact CE1-CG2 3.86Å; F44-T124 HydrophobicContact CZ-CG2 4.26Å; F44-I125 HydrophobicContact CD1-CD1 4.08Å; F44-I125 HydrophobicContact CD1-CG1 3.64Å; F44-I125 HydrophobicContact CE1-CD1 4.33Å; F44-I125 HydrophobicContact CE1-CG1 3.76Å |
| 45 | V | 93.9 | Very high | 93.6 | Very high | 6 Ų | 6 | 32.3 Ų | 32.3 | 4% | 0.036 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62.5 | -40.1 | 172.7 | 177.1 | 0 | 0 | 0 | 0 | 111.5 | V27 T41 N42 L48 A49 I98 Y289 F296 | V27-V45 HydrophobicContact CG1-CG1 3.82Å; T41-V45 PolarHBondContact O-N 3.1Å; N42-V45 PolarHBondContact O-N 3.44Å; V45-L48 PolarHBondContact O-N 3.34Å; V45-A49 WeakPolarHBondContact O-CB 3.5Å; V45-A49 PolarHBondContact O-N 3.02Å; V45-I98 HydrophobicContact CG2-CD1 4.02Å; V45-Y289 HydrophobicContact CG1-CD2 4.25Å; V45-Y289 HydrophobicContact CG1-CE1 4.37Å; V45-Y289 HydrophobicContact CG1-CE2 3.62Å; V45-F296 HydrophobicContact CG1-CZ 4.33Å |
| 46 | V | 95.9 | Very high | 93.9 | Very high | 38 Ų | 38 | 28.4 Ų | 28.4 | 23% | 0.23 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -66.9 | -40 | 173.6 | 169.6 | 0 | 0 | 0 | 0 | 111.5 | V31 N42 F43 F44 L48 A49 V50 | V31-V46 HydrophobicContact CB-CG2 3.88Å; V31-V46 HydrophobicContact CG1-CG2 3.88Å; V31-V46 HydrophobicContact CG2-CG2 3.92Å; N42-V46 WeakPolarHBondContact O-CG2 3.37Å; N42-V46 PolarHBondContact O-N 3.48Å; F43-V46 PolarHBondContact O-N 3.46Å; F44-V46 VanDerWaalsContact C-N 3.34Å; V46-L48 VanDerWaalsContact C-N 3.34Å; V46-L48 PolarHBondContact O-N 3.08Å; V46-A49 PolarHBondContact O-N 3.32Å; V46-V50 HydrophobicContact CG1-CG2 4.44Å; V46-V50 WeakPolarHBondContact O-CG2 3.34Å; V46-V50 PolarHBondContact O-N 2.9Å |
| 47 | S | 95.9 | Very high | 94.3 | Very high | 8 Ų | 8 | 26.2 Ų | 26.2 | 6% | 0.056 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -59.5 | -44.1 | 174.3 | -177 | 0 | 0 | 0 | 0 | 112.2 | F43 F44 V50 A51 W129 | F43-S47 PolarHBondContact O-N 3.3Å; F44-S47 WeakPolarHBondContact O-CB 3.31Å; F44-S47 PolarHBondContact O-N 3.46Å; S47-V50 PolarHBondContact O-N 2.99Å; S47-A51 PolarHBondContact O-N 3.25Å; S47-A51 VanDerWaalsContact O-N 3.11Å; S47-W129 PolarHBondContact OG-NE1 3.36Å; S47-W129 VanDerWaalsContact OG-NE1 3.15Å |
| 48 | L | 94.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.7 | -47.1 | 174.8 | 179.6 | 60.7 | 0 | 0 | 0 | 111.4 | F44 V45 V46 V50 A51 D52 L95 I98 Y289 | F44-L48 PolarHBondContact O-N 2.9Å; V45-L48 PolarHBondContact O-N 3.34Å; V46-L48 VanDerWaalsContact C-N 3.34Å; V46-L48 PolarHBondContact O-N 3.08Å; L48-V50 VanDerWaalsContact C-N 3.3Å; L48-V50 PolarHBondContact O-N 3Å; L48-A51 WeakPolarHBondContact O-CB 3.25Å; L48-A51 PolarHBondContact O-N 2.94Å; L48-A51 VanDerWaalsContact O-N 3.08Å; L48-D52 PolarHBondContact O-N 3.39Å; L48-L95 HydrophobicContact CD2-CD2 3.73Å; L48-L95 HydrophobicContact CD2-CG 4.13Å; L48-I98 HydrophobicContact CD2-CD1 4.44Å; L48-Y289 WeakPolarHBondContact CD2-OH 3.46Å |
| 49 | A | 96.9 | Very high | 94.9 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -60.6 | -36.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | N24 V27 V45 V46 D52 I53 | N24-A49 HydrophobicContact CB-CB 3.99Å; V27-A49 HydrophobicContact CB-CB 4.16Å; V27-A49 HydrophobicContact CG1-CB 3.94Å; V45-A49 WeakPolarHBondContact O-CB 3.5Å; V45-A49 PolarHBondContact O-N 3.02Å; V46-A49 PolarHBondContact O-N 3.32Å; A49-D52 PolarHBondContact O-N 3.31Å; A49-I53 WeakPolarHBondContact O-CD1 3.47Å; A49-I53 WeakPolarHBondContact O-CG1 3.4Å; A49-I53 PolarHBondContact O-N 3.24Å |
| 50 | V | 97.3 | Very high | 95.2 | Very high | 67 Ų | 67 | 22.1 Ų | 22.1 | 41% | 0.406 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -65.8 | -39 | 173.7 | 170 | 0 | 0 | 0 | 0 | 111.6 | V46 S47 L48 A54 W129 | V46-V50 HydrophobicContact CG1-CG2 4.44Å; V46-V50 WeakPolarHBondContact O-CG2 3.34Å; V46-V50 PolarHBondContact O-N 2.9Å; S47-V50 PolarHBondContact O-N 2.99Å; L48-V50 VanDerWaalsContact C-N 3.3Å; L48-V50 PolarHBondContact O-N 3Å; V50-A54 PolarHBondContact O-N 2.91Å; V50-W129 HydrophobicContact CG1-CH2 4.39Å; V50-W129 HydrophobicContact CG1-CZ2 3.99Å |
| 51 | A | 96.6 | Very high | 95.6 | Very high | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -64.2 | -45.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | S47 L48 I53 A54 V55 W129 | S47-A51 PolarHBondContact O-N 3.25Å; S47-A51 VanDerWaalsContact O-N 3.11Å; L48-A51 WeakPolarHBondContact O-CB 3.25Å; L48-A51 PolarHBondContact O-N 2.94Å; L48-A51 VanDerWaalsContact O-N 3.08Å; A51-I53 PolarHBondContact O-N 2.97Å; A51-A54 CarbonylContact O-C 3.54Å; A51-A54 WeakPolarHBondContact O-CA 3.4Å; A51-A54 WeakPolarHBondContact O-CB 3.43Å; A51-A54 PolarHBondContact O-N 3.32Å; A51-A54 VanDerWaalsContact O-N 3.09Å; A51-V55 WeakPolarHBondContact O-CG2 3.37Å; A51-V55 PolarHBondContact O-N 2.58Å; A51-W129 HydrophobicContact CB-CH2 4.36Å; A51-W129 HydrophobicContact CB-CZ2 4.35Å |
| 52 | D | 96.8 | Very high | 96 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -66.4 | -33.5 | 178.8 | -72.5 | -28.4 | 0 | 0 | 0 | 113 | S20 N24 L48 A49 V55 G56 S282 N285 | S20-D52 PolarHBondContact OG-O 3.16Å; N24-D52 HydrophobicContact CB-CB 4.34Å; N24-D52 WeakPolarHBondContact ND2-CB 3.44Å; L48-D52 PolarHBondContact O-N 3.39Å; A49-D52 PolarHBondContact O-N 3.31Å; D52-V55 PolarHBondContact O-N 3.38Å; D52-G56 PolarHBondContact O-N 3.37Å; D52-S282 WeakPolarHBondContact OD1-CA 3.43Å; D52-S282 WeakPolarHBondContact OD1-CB 3.06Å; D52-S282 PolarHBondContact OD1-OG 2.84Å; D52-N285 PolarHBondContact OD2-ND2 3.1Å |
| 53 | I | 98.2 | Very high | 96.1 | Very high | 37 Ų | 37 | 24.7 Ų | 24.7 | 19% | 0.19 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -62.3 | -46.7 | 168.2 | -69.5 | 162.3 | 0 | 0 | 0 | 109.9 | N24 V25 A49 A51 V55 G56 V57 | N24-I53 HydrophobicContact CB-CD1 4.21Å; N24-I53 HydrophobicContact CB-CG1 3.67Å; V25-I53 HydrophobicContact CG2-CD1 3.75Å; V25-I53 HydrophobicContact CG2-CG1 4.14Å; A49-I53 WeakPolarHBondContact O-CD1 3.47Å; A49-I53 WeakPolarHBondContact O-CG1 3.4Å; A49-I53 PolarHBondContact O-N 3.24Å; A51-I53 PolarHBondContact O-N 2.97Å; I53-V55 VanDerWaalsContact C-N 3.26Å; I53-V55 PolarHBondContact O-N 3.25Å; I53-G56 PolarHBondContact O-N 2.68Å; I53-G56 VanDerWaalsContact O-N 3.14Å; I53-V57 HydrophobicContact CG2-CG2 4.05Å; I53-V57 WeakPolarHBondContact O-CG2 3.29Å; I53-V57 PolarHBondContact O-N 2.99Å |
| 54 | A | 97.5 | Very high | 96.1 | Very high | 17 Ų | 17 | 23.2 Ų | 23.2 | 14% | 0.14 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -64.5 | -29.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | V50 A51 L58 A59 L87 | V50-A54 PolarHBondContact O-N 2.91Å; A51-A54 CarbonylContact O-C 3.54Å; A51-A54 WeakPolarHBondContact O-CA 3.4Å; A51-A54 WeakPolarHBondContact O-CB 3.43Å; A51-A54 PolarHBondContact O-N 3.32Å; A51-A54 VanDerWaalsContact O-N 3.09Å; A54-L58 WeakPolarHBondContact O-CB 3.41Å; A54-L58 PolarHBondContact O-N 2.92Å; A54-A59 PolarHBondContact O-N 3.39Å; A54-L87 HydrophobicContact CB-CD1 3.6Å; A54-L87 HydrophobicContact CB-CD2 3.84Å; A54-L87 HydrophobicContact CB-CG 4.41Å |
| 55 | V | 96.9 | Very high | 96.1 | Very high | 8 Ų | 8 | 25.5 Ų | 25.5 | 5% | 0.048 | 15% | 0.152 | C | C | . | . | I | π-helix | trans | -61.5 | -49.1 | 170.8 | 170.6 | 0 | 0 | 0 | 0 | 110 | A51 D52 I53 A59 I60 L87 | A51-V55 WeakPolarHBondContact O-CG2 3.37Å; A51-V55 PolarHBondContact O-N 2.58Å; D52-V55 PolarHBondContact O-N 3.38Å; I53-V55 VanDerWaalsContact C-N 3.26Å; I53-V55 PolarHBondContact O-N 3.25Å; V55-A59 HydrophobicContact CB-CB 4.49Å; V55-A59 HydrophobicContact CG1-CB 4.42Å; V55-A59 PolarHBondContact O-N 3.3Å; V55-A59 VanDerWaalsContact O-N 3.13Å; V55-I60 HydrophobicContact CG1-CD1 4.16Å; V55-I60 HydrophobicContact CG1-CG1 4.09Å; V55-I60 PolarHBondContact O-N 3.33Å; V55-L87 HydrophobicContact CB-CD1 4.46Å; V55-L87 HydrophobicContact CG2-CB 3.95Å; V55-L87 HydrophobicContact CG2-CD1 3.79Å |
| 56 | G | 96.9 | Very high | 96 | Very high | 5 Ų | 5 | 26 Ų | 26 | 5% | 0.052 | 15% | 0.154 | C | C | . | . | I | π-helix | trans | -68.6 | -38.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | A17 D52 I53 | A17-G56 WeakPolarHBondContact CB-O 3.46Å; D52-G56 PolarHBondContact O-N 3.37Å; I53-G56 PolarHBondContact O-N 2.68Å; I53-G56 VanDerWaalsContact O-N 3.14Å |
| 57 | V | 97.9 | Very high | 95.7 | Very high | 79 Ų | 79 | 26 Ų | 26 | 48% | 0.479 | 16% | 0.156 | S | C | . | . | I | π-helix | trans | -80.7 | -31.3 | -177.4 | 177.3 | 0 | 0 | 0 | 0 | 112.9 | V21 I53 | V21-V57 HydrophobicContact CG2-CG2 3.67Å; I53-V57 HydrophobicContact CG2-CG2 4.05Å; I53-V57 WeakPolarHBondContact O-CG2 3.29Å; I53-V57 PolarHBondContact O-N 2.99Å |
| 58 | L | 96.4 | Very high | 95.4 | Very high | 67 Ų | 67 | 29.8 Ų | 29.8 | 35% | 0.351 | 18% | 0.179 | S | C | . | . | I | π-helix | trans | -126.3 | -55.1 | -170.3 | -60 | 173.4 | 0 | 0 | 0 | 112.9 | A54 I60 P61 F62 F83 | A54-L58 WeakPolarHBondContact O-CB 3.41Å; A54-L58 PolarHBondContact O-N 2.92Å; L58-I60 PolarHBondContact O-N 2.81Å; L58-P61 WeakPolarHBondContact O-CD 3.38Å; L58-F62 HydrophobicContact CB-CE2 4.32Å; L58-F62 VanDerWaalsContact O-CB 3.31Å; L58-F62 WeakPolarHBondContact O-CB 3.37Å; L58-F62 WeakPolarHBondContact O-CD1 3.36Å; L58-F62 WeakPolarHBondContact O-CD2 3.3Å; L58-F62 WeakPolarHBondContact O-CG 3.47Å; L58-F62 PolarHBondContact O-N 3.12Å; L58-F83 HydrophobicContact CB-CD1 4.31Å; L58-F83 HydrophobicContact CB-CE1 3.6Å; L58-F83 HydrophobicContact CB-CZ 4.31Å; L58-F83 HydrophobicContact CD1-CE1 3.8Å; L58-F83 HydrophobicContact CD1-CZ 3.61Å; L58-F83 HydrophobicContact CG-CE1 4.36Å |
| 59 | A | 95.8 | Very high | 95.1 | Very high | 1 Ų | 1 | 30.4 Ų | 30.4 | 1% | 0.008 | 18% | 0.184 | C | C | . | . | I | π-helix | trans | -67.7 | -39.1 | -171.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | A54 V55 F62 A63 V84 L87 | A54-A59 PolarHBondContact O-N 3.39Å; V55-A59 HydrophobicContact CB-CB 4.49Å; V55-A59 HydrophobicContact CG1-CB 4.42Å; V55-A59 PolarHBondContact O-N 3.3Å; V55-A59 VanDerWaalsContact O-N 3.13Å; A59-F62 WeakPolarHBondContact O-CB 3.2Å; A59-F62 PolarHBondContact O-N 3.44Å; A59-A63 WeakPolarHBondContact O-CB 3.26Å; A59-A63 PolarHBondContact O-N 2.83Å; A59-V84 HydrophobicContact CB-CB 4.02Å; A59-V84 HydrophobicContact CB-CG2 3.97Å; A59-L87 HydrophobicContact CB-CD1 4.14Å |
| 60 | I | 96.4 | Very high | 94.8 | Very high | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -66.7 | -49.9 | 177 | -69.9 | 175.1 | 0 | 0 | 0 | 111.3 | E13 I16 A17 V55 L58 F62 A63 I64 H279 | E13-I60 HydrophobicContact CB-CG2 3.8Å; E13-I60 WeakPolarHBondContact OE2-CG2 3.41Å; I16-I60 HydrophobicContact CB-CD1 4.34Å; I16-I60 HydrophobicContact CG2-CD1 3.7Å; A17-I60 HydrophobicContact CB-CB 4.23Å; A17-I60 HydrophobicContact CB-CD1 3.94Å; A17-I60 HydrophobicContact CB-CG2 3.99Å; V55-I60 HydrophobicContact CG1-CD1 4.16Å; V55-I60 HydrophobicContact CG1-CG1 4.09Å; V55-I60 PolarHBondContact O-N 3.33Å; L58-I60 PolarHBondContact O-N 2.81Å; I60-F62 VanDerWaalsContact C-N 3.25Å; I60-F62 PolarHBondContact O-N 3.07Å; I60-A63 PolarHBondContact O-N 2.85Å; I60-A63 VanDerWaalsContact O-N 3.13Å; I60-I64 HydrophobicContact CG2-CD1 4.03Å; I60-I64 WeakPolarHBondContact O-CG1 3.48Å; I60-I64 PolarHBondContact O-N 3.19Å; I60-H279 HydrophobicContact CD1-CB 4.09Å; I60-H279 HydrophobicContact CG1-CB 4.29Å |
| 61 | P | 96.3 | Very high | 94.4 | Very high | 48 Ų | 48 | 32.3 Ų | 32.3 | 31% | 0.312 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -53.4 | -40 | 169.8 | -30.8 | 37.2 | 0 | 0 | 0 | 113.7 | L58 I64 V65 | L58-P61 WeakPolarHBondContact O-CD 3.38Å; P61-I64 PolarHBondContact O-N 3Å; P61-V65 WeakPolarHBondContact O-CB 3.27Å; P61-V65 VanDerWaalsContact O-CG2 3.27Å; P61-V65 WeakPolarHBondContact O-CG2 3.28Å; P61-V65 PolarHBondContact O-N 3.07Å |
| 62 | F | 95.5 | Very high | 94.1 | Very high | 51 Ų | 51 | 33.1 Ų | 33.1 | 22% | 0.224 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.2 | -41.6 | 175.4 | -72.1 | -6.5 | 0 | 0 | 0 | 113 | L58 A59 I60 V65 I66 I80 F83 | L58-F62 HydrophobicContact CB-CE2 4.32Å; L58-F62 VanDerWaalsContact O-CB 3.31Å; L58-F62 WeakPolarHBondContact O-CB 3.37Å; L58-F62 WeakPolarHBondContact O-CD1 3.36Å; L58-F62 WeakPolarHBondContact O-CD2 3.3Å; L58-F62 WeakPolarHBondContact O-CG 3.47Å; L58-F62 PolarHBondContact O-N 3.12Å; A59-F62 WeakPolarHBondContact O-CB 3.2Å; A59-F62 PolarHBondContact O-N 3.44Å; I60-F62 VanDerWaalsContact C-N 3.25Å; I60-F62 PolarHBondContact O-N 3.07Å; F62-V65 PolarHBondContact O-N 3.09Å; F62-I66 WeakPolarHBondContact O-CB 3.45Å; F62-I66 WeakPolarHBondContact O-CG1 3.43Å; F62-I66 PolarHBondContact O-N 3Å; F62-I80 HydrophobicContact CB-CG2 3.53Å; F62-I80 HydrophobicContact CD1-CG2 4.1Å; F62-I80 HydrophobicContact CD2-CG2 4.12Å; F62-I80 HydrophobicContact CG-CG2 3.66Å; F62-F83 HydrophobicContact CD2-CB 4.14Å; F62-F83 AromaticContact CD2-CD1 3.84Å; F62-F83 HydrophobicContact CD2-CD1 3.84Å; F62-F83 HydrophobicContact CD2-CG 4.21Å; F62-F83 HydrophobicContact CE2-CB 4.21Å; F62-F83 AromaticContact CE2-CD1 3.77Å; F62-F83 HydrophobicContact CE2-CD1 3.77Å; F62-F83 HydrophobicContact CE2-CE1 4.37Å; F62-F83 AromaticContact CE2-CG 3.97Å; F62-F83 HydrophobicContact CE2-CG 3.97Å |
| 63 | A | 94 | Very high | 93.8 | Very high | 21 Ų | 21 | 37.7 Ų | 37.7 | 17% | 0.174 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.4 | -42.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | A59 I60 I66 S67 | A59-A63 WeakPolarHBondContact O-CB 3.26Å; A59-A63 PolarHBondContact O-N 2.83Å; I60-A63 PolarHBondContact O-N 2.85Å; I60-A63 VanDerWaalsContact O-N 3.13Å; A63-I66 PolarHBondContact O-N 3.48Å; A63-S67 WeakPolarHBondContact O-CB 3.44Å; A63-S67 PolarHBondContact O-N 2.93Å |
| 64 | I | 94.5 | Very high | 93.4 | Very high | 22 Ų | 22 | 38 Ų | 38 | 11% | 0.113 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -58.9 | -49 | 173.3 | -68.1 | 170.4 | 0 | 0 | 0 | 110.3 | Y9 I10 E13 L14 I60 P61 S67 T68 | Y9-I64 HydrophobicContact CE1-CG1 4.49Å; I10-I64 HydrophobicContact CD1-CG2 4.37Å; I10-I64 HydrophobicContact CG1-CG2 3.99Å; I10-I64 HydrophobicContact CG2-CD1 4.44Å; I10-I64 HydrophobicContact CG2-CG2 4.44Å; E13-I64 HydrophobicContact CB-CD1 3.88Å; E13-I64 HydrophobicContact CB-CG1 4.06Å; E13-I64 HydrophobicContact CG-CG1 4.46Å; L14-I64 HydrophobicContact CD2-CD1 4.03Å; L14-I64 HydrophobicContact CG-CD1 4.07Å; I60-I64 HydrophobicContact CG2-CD1 4.03Å; I60-I64 WeakPolarHBondContact O-CG1 3.48Å; I60-I64 PolarHBondContact O-N 3.19Å; P61-I64 PolarHBondContact O-N 3Å; I64-S67 PolarHBondContact O-N 3.42Å; I64-S67 PolarHBondContact O-OG 3.08Å; I64-T68 PolarHBondContact O-N 3.27Å |
| 65 | V | 93.4 | Very high | 93.1 | Very high | 60 Ų | 60 | 43.8 Ų | 43.8 | 36% | 0.364 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -62.5 | -44.4 | 179.7 | 166.5 | 0 | 0 | 0 | 0 | 111.8 | P61 F62 S67 T68 F70 | P61-V65 WeakPolarHBondContact O-CB 3.27Å; P61-V65 VanDerWaalsContact O-CG2 3.27Å; P61-V65 WeakPolarHBondContact O-CG2 3.28Å; P61-V65 PolarHBondContact O-N 3.07Å; F62-V65 PolarHBondContact O-N 3.09Å; V65-S67 VanDerWaalsContact C-N 3.32Å; V65-S67 PolarHBondContact O-N 3.18Å; V65-T68 PolarHBondContact O-N 3.36Å; V65-T68 PolarHBondContact O-OG1 3.45Å; V65-F70 HydrophobicContact CG1-CD1 3.49Å; V65-F70 VanDerWaalsContact CG1-CD1 3.49Å; V65-F70 HydrophobicContact CG1-CD2 4.45Å; V65-F70 HydrophobicContact CG1-CE1 3.37Å; V65-F70 HydrophobicContact CG1-CE2 4.33Å; V65-F70 HydrophobicContact CG1-CG 4.06Å; V65-F70 HydrophobicContact CG1-CZ 3.82Å |
| 66 | I | 92.2 | Very high | 92.8 | Very high | 18 Ų | 18 | 44.9 Ų | 44.9 | 9% | 0.092 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.2 | -39.2 | 174.3 | -72.7 | 172.7 | 0 | 0 | 0 | 111.4 | F62 A63 T68 G69 I80 A81 F169 | F62-I66 WeakPolarHBondContact O-CB 3.45Å; F62-I66 WeakPolarHBondContact O-CG1 3.43Å; F62-I66 PolarHBondContact O-N 3Å; A63-I66 PolarHBondContact O-N 3.48Å; I66-T68 PolarHBondContact O-N 2.92Å; I66-T68 VanDerWaalsContact O-N 3.08Å; I66-G69 PolarHBondContact O-N 3.49Å; I66-I80 HydrophobicContact CD1-CB 4.3Å; I66-I80 HydrophobicContact CD1-CG2 3.62Å; I66-I80 HydrophobicContact CG1-CG2 3.85Å; I66-A81 HydrophobicContact CD1-CB 3.9Å; I66-F169 HydrophobicContact CG2-CB 4.29Å |
| 67 | S | 90.3 | Very high | 92.7 | Very high | 37 Ų | 37 | 44.7 Ų | 44.7 | 26% | 0.259 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -63.1 | -18.3 | -179.1 | 78.1 | 0 | 0 | 0 | 0 | 113.8 | A63 I64 V65 | A63-S67 WeakPolarHBondContact O-CB 3.44Å; A63-S67 PolarHBondContact O-N 2.93Å; I64-S67 PolarHBondContact O-N 3.42Å; I64-S67 PolarHBondContact O-OG 3.08Å; V65-S67 VanDerWaalsContact C-N 3.32Å; V65-S67 PolarHBondContact O-N 3.18Å |
| 68 | T | 89.3 | Confident | 92.5 | Very high | 88 Ų | 88 | 40.9 Ų | 40.9 | 54% | 0.54 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81.5 | -12.8 | 173.4 | 71 | 0 | 0 | 0 | 0 | 114.6 | I64 V65 I66 F70 | I64-T68 PolarHBondContact O-N 3.27Å; V65-T68 PolarHBondContact O-N 3.36Å; V65-T68 PolarHBondContact O-OG1 3.45Å; I66-T68 PolarHBondContact O-N 2.92Å; I66-T68 VanDerWaalsContact O-N 3.08Å; T68-F70 VanDerWaalsContact C-N 3.31Å; T68-F70 PolarHBondContact O-N 2.9Å |
| 69 | G | 87.8 | Confident | 92.4 | Very high | 12 Ų | 12 | 41.7 Ų | 41.7 | 12% | 0.124 | 23% | 0.231 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 67.7 | 25.4 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | I66 K166 | I66-G69 PolarHBondContact O-N 3.49Å; G69-K166 WeakPolarHBondContact O-CA 3.32Å; G69-K166 WeakPolarHBondContact O-CB 3.34Å |
| 70 | F | 90.1 | Very high | 92.3 | Very high | 63 Ų | 63 | 43 Ų | 43 | 28% | 0.276 | 24% | 0.237 | S | C | . | . | trans | -53.8 | 149.2 | -175.4 | 82.4 | -68.8 | 0 | 0 | 0 | 113.9 | V65 T68 S72 I80 C167 | V65-F70 HydrophobicContact CG1-CD1 3.49Å; V65-F70 VanDerWaalsContact CG1-CD1 3.49Å; V65-F70 HydrophobicContact CG1-CD2 4.45Å; V65-F70 HydrophobicContact CG1-CE1 3.37Å; V65-F70 HydrophobicContact CG1-CE2 4.33Å; V65-F70 HydrophobicContact CG1-CG 4.06Å; V65-F70 HydrophobicContact CG1-CZ 3.82Å; T68-F70 VanDerWaalsContact C-N 3.31Å; T68-F70 PolarHBondContact O-N 2.9Å; F70-S72 PolarHBondContact O-N 3.36Å; F70-I80 HydrophobicContact CZ-CD1 3.95Å; F70-C167 HydrophobicContact CD1-CB 3.76Å; F70-C167 HydrophobicContact CE1-CB 3.5Å; F70-C167 VanDerWaalsContact CE1-CB 3.5Å; F70-C167 HydrophobicContact CZ-CB 4.18Å; F70-C167 VanDerWaalsContact O-CB 3.26Å; F70-C167 WeakPolarHBondContact O-CB 3.32Å; F70-C167 PolarHBondContact O-N 3.28Å | ||
| 71 | C | 89.7 | Confident | 92.2 | Very high | 44 Ų | 44 | 43 Ų | 43 | 30% | 0.297 | 24% | 0.238 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -70.9 | 125.7 | 177.4 | -63.7 | 0 | 0 | 0 | 0 | 111.2 | C160 Q164 M165 | C71-C160 HydrophobicContact CB-CB 3.77Å; C71-C160 WeakPolarHBondContact CB-SG 3.38Å; C71-C160 WeakPolarHBondContact SG-CA 3.5Å; C71-C160 WeakPolarHBondContact SG-CB 3.47Å; C71-C160 CovalentContact SG-SG 2.04Å; C71-C160 PolarHBondContact SG-SG 3.39Å; C71-Q164 HydrophobicContact CB-CB 4.5Å; C71-M165 WeakPolarHBondContact CA-O 3.48Å |
| 72 | S | 90.8 | Very high | 92.1 | Very high | 18 Ų | 18 | 40.7 Ų | 40.7 | 13% | 0.126 | 22% | 0.223 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -147.4 | 162.5 | 179.6 | -169.6 | 0 | 0 | 0 | 0 | 111.9 | F70 Q164 M165 | F70-S72 PolarHBondContact O-N 3.36Å; S72-Q164 WeakPolarHBondContact O-CA 3.29Å; S72-M165 PolarHBondContact N-O 3.45Å; S72-M165 PolarHBondContact O-N 2.95Å |
| 73 | N | 90.6 | Very high | 92.1 | Very high | 96 Ų | 96 | 40 Ų | 40 | 51% | 0.513 | 22% | 0.22 | S | C | . | . | trans | -69.4 | 144.2 | 167.3 | -62.1 | -14.6 | 0 | 0 | 0 | 109.3 | Y75 G76 C77 | N73-Y75 PolarHBondContact O-N 2.85Å; N73-G76 PolarHBondContact O-N 2.88Å; N73-C77 PolarHBondContact O-N 3.14Å | ||
| 74 | F | 88.8 | Confident | 92 | Very high | 42 Ų | 42 | 40.5 Ų | 40.5 | 18% | 0.184 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -48.7 | -56.8 | -175.7 | 178.1 | -103.3 | 0 | 0 | 0 | 113.9 | G76 C77 L78 H144 K145 M165 V172 | F74-G76 VanDerWaalsContact C-N 3.29Å; F74-G76 PolarHBondContact O-N 2.9Å; F74-C77 WeakPolarHBondContact O-CB 3.43Å; F74-C77 PolarHBondContact O-N 3.11Å; F74-L78 HydrophobicContact CE1-CD2 4.13Å; F74-L78 HydrophobicContact CZ-CD2 4.38Å; F74-L78 WeakPolarHBondContact O-CB 3.46Å; F74-L78 PolarHBondContact O-N 2.82Å; F74-H144 HydrophobicContact CE1-CB 4.46Å; F74-H144 AromaticContact CE1-CD2 3.7Å; F74-H144 AromaticContact CE1-CE1 3.93Å; F74-H144 AromaticContact CE1-CG 3.8Å; F74-H144 AromaticContact CE1-ND1 3.94Å; F74-H144 AromaticContact CE1-NE2 3.79Å; F74-H144 HydrophobicContact CZ-CB 3.95Å; F74-H144 AromaticContact CZ-CG 3.67Å; F74-H144 AromaticContact CZ-ND1 3.78Å; F74-K145 WeakPolarHBondContact CE2-O 3.43Å; F74-K145 VanDerWaalsContact CZ-O 3.27Å; F74-K145 WeakPolarHBondContact CZ-O 3.36Å; F74-M165 HydrophobicContact CD2-SD 3.8Å; F74-V172 HydrophobicContact CD2-CG1 4.12Å; F74-V172 HydrophobicContact CE2-CB 4.15Å; F74-V172 HydrophobicContact CE2-CG1 3.98Å |
| 75 | Y | 90.8 | Very high | 92 | Very high | 139 Ų | 139 | 40 Ų | 40 | 55% | 0.545 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -66.1 | -28.2 | -179.2 | -69.9 | -70.3 | 0 | 0 | 0 | 113.9 | N73 L78 F79 H144 | N73-Y75 PolarHBondContact O-N 2.85Å; Y75-L78 HydrophobicContact CD1-CD2 4.44Å; Y75-F79 WeakPolarHBondContact O-CB 3.48Å; Y75-F79 PolarHBondContact O-N 3.36Å; Y75-H144 AromaticContact CE1-NE2 3.83Å |
| 76 | G | 92.3 | Very high | 92.2 | Very high | 32 Ų | 32 | 37.4 Ų | 37.4 | 33% | 0.33 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -68.4 | -46.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | N73 F74 F79 I80 | N73-G76 PolarHBondContact O-N 2.88Å; F74-G76 VanDerWaalsContact C-N 3.29Å; F74-G76 PolarHBondContact O-N 2.9Å; G76-F79 PolarHBondContact O-N 2.86Å; G76-I80 WeakPolarHBondContact O-CD1 3.48Å; G76-I80 VanDerWaalsContact O-CG1 3.26Å; G76-I80 WeakPolarHBondContact O-CG1 3.39Å; G76-I80 PolarHBondContact O-N 2.98Å |
| 77 | C | 93.4 | Very high | 92.4 | Very high | 0 Ų | 0 | 36.7 Ų | 36.7 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -60.2 | -46.6 | 172.9 | -177 | 0 | 0 | 0 | 0 | 112.1 | N73 F74 F79 I80 A81 C167 V172 | N73-C77 PolarHBondContact O-N 3.14Å; F74-C77 WeakPolarHBondContact O-CB 3.43Å; F74-C77 PolarHBondContact O-N 3.11Å; C77-F79 PolarHBondContact O-N 3.11Å; C77-I80 PolarHBondContact O-N 3.17Å; C77-A81 WeakPolarHBondContact O-CB 3.35Å; C77-A81 PolarHBondContact O-N 3.34Å; C77-C167 WeakPolarHBondContact CA-SG 3.43Å; C77-C167 HydrophobicContact CB-CB 3.74Å; C77-C167 WeakPolarHBondContact CB-SG 3.47Å; C77-C167 WeakPolarHBondContact SG-CA 3.29Å; C77-C167 WeakPolarHBondContact SG-CB 3.11Å; C77-C167 CovalentContact SG-SG 2.03Å; C77-C167 PolarHBondContact SG-SG 3.33Å; C77-V172 HydrophobicContact CB-CG1 4.33Å |
| 78 | L | 93.4 | Very high | 92.4 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -61.6 | -42 | -179.7 | -173.3 | 64.4 | 0 | 0 | 0 | 112 | F74 Y75 A81 C82 P139 M140 H144 V172 V173 | F74-L78 HydrophobicContact CE1-CD2 4.13Å; F74-L78 HydrophobicContact CZ-CD2 4.38Å; F74-L78 WeakPolarHBondContact O-CB 3.46Å; F74-L78 PolarHBondContact O-N 2.82Å; Y75-L78 HydrophobicContact CD1-CD2 4.44Å; L78-A81 PolarHBondContact O-N 3.07Å; L78-C82 VanDerWaalsContact O-CB 3.26Å; L78-C82 WeakPolarHBondContact O-CB 3.48Å; L78-C82 PolarHBondContact O-N 3.09Å; L78-C82 PolarHBondContact O-SG 3.41Å; L78-C82 VanDerWaalsContact O-SG 3.33Å; L78-P139 HydrophobicContact CD1-CB 4Å; L78-M140 HydrophobicContact CD2-CB 4.44Å; L78-M140 HydrophobicContact CD2-CG 3.94Å; L78-M140 HydrophobicContact CG-CG 4.01Å; L78-H144 HydrophobicContact CD1-CB 4.15Å; L78-H144 HydrophobicContact CD2-CB 3.74Å; L78-V172 HydrophobicContact CD1-CB 4.09Å; L78-V172 HydrophobicContact CD1-CG2 4.03Å; L78-V173 HydrophobicContact CD1-CG2 4.4Å |
| 79 | F | 95.2 | Very high | 92.7 | Very high | 83 Ų | 83 | 31 Ų | 31 | 36% | 0.364 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -59.8 | -48.3 | 174.5 | 174.4 | -98.2 | 0 | 0 | 0 | 112.1 | Y75 G76 C77 A81 C82 F83 M140 | Y75-F79 WeakPolarHBondContact O-CB 3.48Å; Y75-F79 PolarHBondContact O-N 3.36Å; G76-F79 PolarHBondContact O-N 2.86Å; C77-F79 PolarHBondContact O-N 3.11Å; F79-A81 VanDerWaalsContact C-N 3.31Å; F79-A81 PolarHBondContact O-N 3.39Å; F79-C82 PolarHBondContact O-N 2.97Å; F79-F83 HydrophobicContact CE2-CD2 4.47Å; F79-F83 AromaticContact CZ-CD2 3.98Å; F79-F83 HydrophobicContact CZ-CD2 3.98Å; F79-F83 WeakPolarHBondContact O-CB 3.37Å; F79-F83 PolarHBondContact O-N 3.04Å; F79-M140 HydrophobicContact CB-CE 4.05Å; F79-M140 HydrophobicContact CB-SD 4.03Å; F79-M140 HydrophobicContact CD2-CE 4.28Å; F79-M140 HydrophobicContact CD2-SD 3.92Å; F79-M140 HydrophobicContact CG-SD 4.49Å |
| 80 | I | 94.4 | Very high | 93.1 | Very high | 28 Ų | 28 | 30.4 Ų | 30.4 | 14% | 0.144 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -61 | -42.1 | 179.3 | -65 | 168.9 | 0 | 0 | 0 | 110.3 | F62 I66 F70 G76 C77 | F62-I80 HydrophobicContact CB-CG2 3.53Å; F62-I80 HydrophobicContact CD1-CG2 4.1Å; F62-I80 HydrophobicContact CD2-CG2 4.12Å; F62-I80 HydrophobicContact CG-CG2 3.66Å; I66-I80 HydrophobicContact CD1-CB 4.3Å; I66-I80 HydrophobicContact CD1-CG2 3.62Å; I66-I80 HydrophobicContact CG1-CG2 3.85Å; F70-I80 HydrophobicContact CZ-CD1 3.95Å; G76-I80 WeakPolarHBondContact O-CD1 3.48Å; G76-I80 VanDerWaalsContact O-CG1 3.26Å; G76-I80 WeakPolarHBondContact O-CG1 3.39Å; G76-I80 PolarHBondContact O-N 2.98Å; C77-I80 PolarHBondContact O-N 3.17Å |
| 81 | A | 93.7 | Very high | 93.2 | Very high | 1 Ų | 1 | 27.6 Ų | 27.6 | 1% | 0.008 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -68.2 | -37.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | I66 C77 L78 F79 F169 V172 V173 | I66-A81 HydrophobicContact CD1-CB 3.9Å; C77-A81 WeakPolarHBondContact O-CB 3.35Å; C77-A81 PolarHBondContact O-N 3.34Å; L78-A81 PolarHBondContact O-N 3.07Å; F79-A81 VanDerWaalsContact C-N 3.31Å; F79-A81 PolarHBondContact O-N 3.39Å; A81-F169 HydrophobicContact CB-CD2 3.92Å; A81-F169 HydrophobicContact CB-CE2 4.35Å; A81-V172 HydrophobicContact CB-CG2 4.06Å; A81-V173 HydrophobicContact CB-CG2 4.07Å |
| 82 | C | 95.1 | Very high | 93.4 | Very high | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -80.8 | -23.6 | 179.8 | -74 | 0 | 0 | 0 | 0 | 113.7 | L78 F79 V84 L85 V86 G136 L137 | L78-C82 VanDerWaalsContact O-CB 3.26Å; L78-C82 WeakPolarHBondContact O-CB 3.48Å; L78-C82 PolarHBondContact O-N 3.09Å; L78-C82 PolarHBondContact O-SG 3.41Å; L78-C82 VanDerWaalsContact O-SG 3.33Å; F79-C82 PolarHBondContact O-N 2.97Å; C82-V84 VanDerWaalsContact C-N 3.33Å; C82-V84 PolarHBondContact O-N 3.11Å; C82-L85 VanDerWaalsContact O-CB 3.29Å; C82-L85 WeakPolarHBondContact O-CB 3.34Å; C82-L85 PolarHBondContact O-N 3.08Å; C82-V86 PolarHBondContact O-N 3.46Å; C82-G136 WeakPolarHBondContact CB-O 3.47Å; C82-L137 HydrophobicContact CB-CD2 3.82Å |
| 83 | F | 95.3 | Very high | 93.6 | Very high | 37 Ų | 37 | 26 Ų | 26 | 16% | 0.162 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -61 | -38.1 | -175.2 | -174.1 | -96.7 | 0 | 0 | 0 | 113.2 | L58 F62 F79 L85 V86 L87 | L58-F83 HydrophobicContact CB-CD1 4.31Å; L58-F83 HydrophobicContact CB-CE1 3.6Å; L58-F83 HydrophobicContact CB-CZ 4.31Å; L58-F83 HydrophobicContact CD1-CE1 3.8Å; L58-F83 HydrophobicContact CD1-CZ 3.61Å; L58-F83 HydrophobicContact CG-CE1 4.36Å; F62-F83 HydrophobicContact CD2-CB 4.14Å; F62-F83 AromaticContact CD2-CD1 3.84Å; F62-F83 HydrophobicContact CD2-CD1 3.84Å; F62-F83 HydrophobicContact CD2-CG 4.21Å; F62-F83 HydrophobicContact CE2-CB 4.21Å; F62-F83 AromaticContact CE2-CD1 3.77Å; F62-F83 HydrophobicContact CE2-CD1 3.77Å; F62-F83 HydrophobicContact CE2-CE1 4.37Å; F62-F83 AromaticContact CE2-CG 3.97Å; F62-F83 HydrophobicContact CE2-CG 3.97Å; F79-F83 HydrophobicContact CE2-CD2 4.47Å; F79-F83 AromaticContact CZ-CD2 3.98Å; F79-F83 HydrophobicContact CZ-CD2 3.98Å; F79-F83 WeakPolarHBondContact O-CB 3.37Å; F79-F83 PolarHBondContact O-N 3.04Å; F83-L85 VanDerWaalsContact C-N 3.27Å; F83-L85 PolarHBondContact O-N 3.42Å; F83-V86 WeakPolarHBondContact O-CB 3.47Å; F83-V86 PolarHBondContact O-N 2.91Å; F83-L87 HydrophobicContact CD1-CD1 4.34Å; F83-L87 HydrophobicContact CE1-CD1 3.68Å; F83-L87 HydrophobicContact CE1-CG 4.08Å; F83-L87 HydrophobicContact CZ-CD1 4.3Å; F83-L87 HydrophobicContact CZ-CD2 4.41Å; F83-L87 HydrophobicContact CZ-CG 4.39Å; F83-L87 PolarHBondContact O-N 3.46Å |
| 84 | V | 92.1 | Very high | 93.7 | Very high | 30 Ų | 30 | 21.5 Ų | 21.5 | 18% | 0.182 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -63.3 | -33 | 174.6 | 65.6 | 0 | 0 | 0 | 0 | 112.2 | A59 C82 V86 L87 T88 | A59-V84 HydrophobicContact CB-CB 4.02Å; A59-V84 HydrophobicContact CB-CG2 3.97Å; C82-V84 VanDerWaalsContact C-N 3.33Å; C82-V84 PolarHBondContact O-N 3.11Å; V84-V86 VanDerWaalsContact C-N 3.35Å; V84-V86 PolarHBondContact O-N 3.34Å; V84-L87 PolarHBondContact O-N 3.19Å; V84-T88 WeakPolarHBondContact O-CB 3.29Å; V84-T88 PolarHBondContact O-N 3.15Å; V84-T88 PolarHBondContact O-OG1 2.78Å |
| 85 | L | 94.3 | Very high | 93.7 | Very high | 11 Ų | 11 | 20 Ų | 20 | 6% | 0.058 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -67.4 | -36.3 | 178 | -51.2 | -180 | 0 | 0 | 0 | 111.5 | C82 F83 T88 Q89 Y177 M178 | C82-L85 VanDerWaalsContact O-CB 3.29Å; C82-L85 WeakPolarHBondContact O-CB 3.34Å; C82-L85 PolarHBondContact O-N 3.08Å; F83-L85 VanDerWaalsContact C-N 3.27Å; F83-L85 PolarHBondContact O-N 3.42Å; L85-T88 PolarHBondContact O-N 2.84Å; L85-Q89 WeakPolarHBondContact O-CB 3.09Å; L85-Q89 PolarHBondContact O-N 2.9Å; L85-Y177 HydrophobicContact CD1-CE1 3.8Å; L85-M178 HydrophobicContact CD1-SD 3.94Å; L85-M178 HydrophobicContact CD2-CE 3.95Å; L85-M178 HydrophobicContact CD2-SD 4.21Å |
| 86 | V | 96.9 | Very high | 93.8 | Very high | 7 Ų | 7 | 14.4 Ų | 14.4 | 4% | 0.042 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -60.4 | -49.7 | 174.2 | 176.4 | 0 | 0 | 0 | 0 | 110.8 | C82 F83 V84 Q89 N90 S132 I133 L137 | C82-V86 PolarHBondContact O-N 3.46Å; F83-V86 WeakPolarHBondContact O-CB 3.47Å; F83-V86 PolarHBondContact O-N 2.91Å; V84-V86 VanDerWaalsContact C-N 3.35Å; V84-V86 PolarHBondContact O-N 3.34Å; V86-Q89 PolarHBondContact O-N 3.39Å; V86-N90 PolarHBondContact O-N 2.93Å; V86-S132 WeakPolarHBondContact O-CB 3.47Å; V86-I133 HydrophobicContact CG1-CB 4.42Å; V86-I133 HydrophobicContact CG1-CG1 3.72Å; V86-L137 HydrophobicContact CG2-CD2 3.72Å; V86-L137 HydrophobicContact CG2-CG 3.81Å |
| 87 | L | 95.4 | Very high | 93.8 | Very high | 3 Ų | 3 | 13.5 Ų | 13.5 | 2% | 0.016 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -66.5 | -41.5 | -179.8 | -61.6 | -174.2 | 0 | 0 | 0 | 111.9 | A54 V55 A59 F83 V84 Q89 N90 S91 W129 | A54-L87 HydrophobicContact CB-CD1 3.6Å; A54-L87 HydrophobicContact CB-CD2 3.84Å; A54-L87 HydrophobicContact CB-CG 4.41Å; V55-L87 HydrophobicContact CB-CD1 4.46Å; V55-L87 HydrophobicContact CG2-CB 3.95Å; V55-L87 HydrophobicContact CG2-CD1 3.79Å; A59-L87 HydrophobicContact CB-CD1 4.14Å; F83-L87 HydrophobicContact CD1-CD1 4.34Å; F83-L87 HydrophobicContact CE1-CD1 3.68Å; F83-L87 HydrophobicContact CE1-CG 4.08Å; F83-L87 HydrophobicContact CZ-CD1 4.3Å; F83-L87 HydrophobicContact CZ-CD2 4.41Å; F83-L87 HydrophobicContact CZ-CG 4.39Å; F83-L87 PolarHBondContact O-N 3.46Å; V84-L87 PolarHBondContact O-N 3.19Å; L87-Q89 VanDerWaalsContact C-N 3.33Å; L87-Q89 PolarHBondContact O-N 3.19Å; L87-N90 PolarHBondContact O-N 2.91Å; L87-S91 PolarHBondContact O-N 2.77Å; L87-S91 PolarHBondContact O-OG 3.48Å; L87-W129 HydrophobicContact CD2-CH2 4.19Å; L87-W129 HydrophobicContact CD2-CZ3 4.1Å |
| 88 | T | 92.3 | Very high | 93.7 | Very high | 4 Ų | 4 | 14.3 Ų | 14.3 | 3% | 0.025 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -54.1 | -50.1 | 173.4 | -57.6 | 0 | 0 | 0 | 0 | 111 | V84 L85 N90 S91 I92 W247 | V84-T88 WeakPolarHBondContact O-CB 3.29Å; V84-T88 PolarHBondContact O-N 3.15Å; V84-T88 PolarHBondContact O-OG1 2.78Å; L85-T88 PolarHBondContact O-N 2.84Å; T88-N90 VanDerWaalsContact C-N 3.32Å; T88-N90 PolarHBondContact O-N 3.25Å; T88-S91 PolarHBondContact O-N 2.98Å; T88-I92 HydrophobicContact CG2-CD1 4.05Å; T88-I92 WeakPolarHBondContact O-CG1 3.48Å; T88-I92 PolarHBondContact O-N 2.95Å; T88-W247 HydrophobicContact CG2-CD2 4.23Å; T88-W247 HydrophobicContact CG2-CE3 3.88Å; T88-W247 HydrophobicContact CG2-CH2 3.42Å; T88-W247 VanDerWaalsContact CG2-CH2 3.42Å; T88-W247 HydrophobicContact CG2-CZ2 3.77Å; T88-W247 HydrophobicContact CG2-CZ3 3.46Å; T88-W247 VanDerWaalsContact CG2-CZ3 3.46Å; T88-W247 WeakPolarHBondContact OG1-CH2 3.01Å |
| 89 | Q | 95.1 | Very high | 93.4 | Very high | 0 Ų | 0 | 14.3 Ų | 14.3 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -65 | -37.7 | -178.6 | -165.2 | 61.4 | 46.4 | 0 | 0 | 112 | L85 V86 L87 S91 I92 F93 S132 I135 C186 | L85-Q89 WeakPolarHBondContact O-CB 3.09Å; L85-Q89 PolarHBondContact O-N 2.9Å; V86-Q89 PolarHBondContact O-N 3.39Å; L87-Q89 VanDerWaalsContact C-N 3.33Å; L87-Q89 PolarHBondContact O-N 3.19Å; Q89-S91 VanDerWaalsContact C-N 3.34Å; Q89-I92 PolarHBondContact O-N 3.39Å; Q89-F93 HydrophobicContact CG-CD2 4.04Å; Q89-F93 HydrophobicContact CG-CE2 3.51Å; Q89-F93 HydrophobicContact CG-CZ 3.86Å; Q89-F93 VanDerWaalsContact NE2-CE1 3.29Å; Q89-F93 WeakPolarHBondContact O-CD2 3.47Å; Q89-F93 WeakPolarHBondContact O-CG 3.27Å; Q89-F93 PolarHBondContact O-N 3.37Å; Q89-S132 VanDerWaalsContact C-OG 3.23Å; Q89-S132 PolarHBondContact O-OG 3.13Å; Q89-I135 HydrophobicContact CG-CB 4.23Å; Q89-I135 HydrophobicContact CG-CD1 4.13Å; Q89-I135 HydrophobicContact CG-CG2 3.97Å; Q89-C186 PolarHBondContact NE2-O 2.95Å; Q89-C186 VanDerWaalsContact OE1-CB 3.27Å; Q89-C186 PolarHBondContact OE1-O 3.15Å |
| 90 | N | 95.7 | Very high | 93.2 | Very high | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -69.6 | -34.6 | 178.5 | -173.6 | 61.5 | 0 | 0 | 0 | 111.8 | V86 L87 T88 S94 W129 S132 | V86-N90 PolarHBondContact O-N 2.93Å; L87-N90 PolarHBondContact O-N 2.91Å; T88-N90 VanDerWaalsContact C-N 3.32Å; T88-N90 PolarHBondContact O-N 3.25Å; N90-S94 VanDerWaalsContact O-CB 3.27Å; N90-S94 WeakPolarHBondContact O-CB 3.26Å; N90-S94 PolarHBondContact O-N 3.37Å; N90-S94 PolarHBondContact O-OG 3.39Å; N90-W129 WeakPolarHBondContact ND2-CZ2 3.06Å; N90-W129 PolarHBondContact ND2-NE1 3.46Å; N90-S132 WeakPolarHBondContact CA-OG 3.37Å; N90-S132 WeakPolarHBondContact CB-OG 3.43Å; N90-S132 PolarHBondContact N-OG 3.32Å |
| 91 | S | 92.9 | Very high | 93 | Very high | 4 Ų | 4 | 13 Ų | 13 | 3% | 0.028 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -64.9 | -43.3 | 171.8 | -63.9 | 0 | 0 | 0 | 0 | 111.7 | L87 T88 Q89 S94 L95 | L87-S91 PolarHBondContact O-N 2.77Å; L87-S91 PolarHBondContact O-OG 3.48Å; T88-S91 PolarHBondContact O-N 2.98Å; Q89-S91 VanDerWaalsContact C-N 3.34Å; S91-S94 PolarHBondContact O-N 3.49Å; S91-L95 WeakPolarHBondContact O-CB 3.28Å; S91-L95 VanDerWaalsContact O-CG 3.32Å; S91-L95 WeakPolarHBondContact O-CG 3.49Å; S91-L95 PolarHBondContact O-N 3.15Å |
| 92 | I | 92.8 | Very high | 92.6 | Very high | 1 Ų | 1 | 16 Ų | 16 | 1% | 0.005 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -58.3 | -51 | 174.1 | -70.3 | 161.9 | 0 | 0 | 0 | 111.2 | T88 Q89 S94 L95 L96 V187 P190 F243 | T88-I92 HydrophobicContact CG2-CD1 4.05Å; T88-I92 WeakPolarHBondContact O-CG1 3.48Å; T88-I92 PolarHBondContact O-N 2.95Å; Q89-I92 PolarHBondContact O-N 3.39Å; I92-S94 VanDerWaalsContact C-N 3.35Å; I92-S94 PolarHBondContact O-N 3.13Å; I92-L95 PolarHBondContact O-N 3.43Å; I92-L96 WeakPolarHBondContact O-CB 3.19Å; I92-L96 PolarHBondContact O-N 2.94Å; I92-V187 HydrophobicContact CD1-CB 4.12Å; I92-V187 HydrophobicContact CD1-CG1 4.17Å; I92-V187 HydrophobicContact CD1-CG2 3.53Å; I92-P190 HydrophobicContact CG2-CB 3.49Å; I92-P190 VanDerWaalsContact CG2-CB 3.49Å; I92-P190 HydrophobicContact CG2-CG 3.96Å; I92-F243 HydrophobicContact CD1-CZ 4.03Å; I92-F243 HydrophobicContact CG1-CE1 4.16Å; I92-F243 HydrophobicContact CG1-CE2 4.01Å; I92-F243 HydrophobicContact CG1-CZ 3.37Å |
| 93 | F | 94.4 | Very high | 92.1 | Very high | 28 Ų | 28 | 19.9 Ų | 19.9 | 12% | 0.123 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -66.7 | -35.5 | -179.9 | -66.4 | -34.7 | 0 | 0 | 0 | 112.8 | Q89 L96 A97 C128 L131 S132 I135 | Q89-F93 HydrophobicContact CG-CD2 4.04Å; Q89-F93 HydrophobicContact CG-CE2 3.51Å; Q89-F93 HydrophobicContact CG-CZ 3.86Å; Q89-F93 VanDerWaalsContact NE2-CE1 3.29Å; Q89-F93 WeakPolarHBondContact O-CD2 3.47Å; Q89-F93 WeakPolarHBondContact O-CG 3.27Å; Q89-F93 PolarHBondContact O-N 3.37Å; F93-L96 PolarHBondContact O-N 2.88Å; F93-A97 VanDerWaalsContact O-CB 3.31Å; F93-A97 WeakPolarHBondContact O-CB 3.48Å; F93-A97 PolarHBondContact O-N 3Å; F93-C128 HydrophobicContact CB-CB 3.88Å; F93-C128 HydrophobicContact CD2-CB 4.41Å; F93-L131 HydrophobicContact CD2-CD2 4.46Å; F93-L131 HydrophobicContact CE1-CD2 4.36Å; F93-L131 HydrophobicContact CE2-CB 3.97Å; F93-L131 HydrophobicContact CE2-CD2 3.6Å; F93-L131 HydrophobicContact CE2-CG 3.62Å; F93-L131 HydrophobicContact CZ-CD2 3.53Å; F93-L131 HydrophobicContact CZ-CG 3.89Å; F93-S132 VanDerWaalsContact CD2-OG 3.29Å; F93-S132 WeakPolarHBondContact CD2-OG 3.48Å; F93-I135 HydrophobicContact CE2-CD1 4.03Å; F93-I135 HydrophobicContact CZ-CD1 3.69Å |
| 94 | S | 93.3 | Very high | 91.9 | Very high | 2 Ų | 2 | 19.3 Ų | 19.3 | 1% | 0.014 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -65 | -42.3 | 174.5 | -61.4 | 0 | 0 | 0 | 0 | 111.7 | N90 S91 I92 A97 I98 | N90-S94 VanDerWaalsContact O-CB 3.27Å; N90-S94 WeakPolarHBondContact O-CB 3.26Å; N90-S94 PolarHBondContact O-N 3.37Å; N90-S94 PolarHBondContact O-OG 3.39Å; S91-S94 PolarHBondContact O-N 3.49Å; I92-S94 VanDerWaalsContact C-N 3.35Å; I92-S94 PolarHBondContact O-N 3.13Å; S94-A97 PolarHBondContact O-N 3.2Å; S94-I98 WeakPolarHBondContact O-CD1 3.42Å; S94-I98 VanDerWaalsContact O-CG1 3.26Å; S94-I98 WeakPolarHBondContact O-CG1 3.49Å; S94-I98 PolarHBondContact O-N 3.44Å |
| 95 | L | 89.3 | Confident | 91.5 | Very high | 9 Ų | 9 | 19 Ų | 19 | 5% | 0.047 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -65.3 | -40.6 | 174.9 | -72.9 | 170.2 | 0 | 0 | 0 | 112.5 | L48 S91 I92 I98 A99 M194 I239 F243 | L48-L95 HydrophobicContact CD2-CD2 3.73Å; L48-L95 HydrophobicContact CD2-CG 4.13Å; S91-L95 WeakPolarHBondContact O-CB 3.28Å; S91-L95 VanDerWaalsContact O-CG 3.32Å; S91-L95 WeakPolarHBondContact O-CG 3.49Å; S91-L95 PolarHBondContact O-N 3.15Å; I92-L95 PolarHBondContact O-N 3.43Å; L95-I98 PolarHBondContact O-N 2.99Å; L95-A99 PolarHBondContact O-N 3.43Å; L95-M194 HydrophobicContact CB-SD 3.77Å; L95-I239 HydrophobicContact CD2-CG2 3.99Å; L95-F243 HydrophobicContact CD1-CB 4.46Å; L95-F243 HydrophobicContact CD1-CD2 3.39Å; L95-F243 HydrophobicContact CD1-CE2 3.9Å; L95-F243 HydrophobicContact CD1-CG 4.04Å |
| 96 | L | 92.5 | Very high | 90.8 | Very high | 23 Ų | 23 | 20.9 Ų | 20.9 | 12% | 0.12 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -65.3 | -42.2 | 174.7 | 176.8 | 61.4 | 0 | 0 | 0 | 111.7 | I92 F93 I98 A99 I100 P190 L193 M194 I197 | I92-L96 WeakPolarHBondContact O-CB 3.19Å; I92-L96 PolarHBondContact O-N 2.94Å; F93-L96 PolarHBondContact O-N 2.88Å; L96-I98 VanDerWaalsContact C-N 3.33Å; L96-I98 PolarHBondContact O-N 3.44Å; L96-A99 WeakPolarHBondContact O-CB 3.34Å; L96-A99 PolarHBondContact O-N 2.9Å; L96-A99 VanDerWaalsContact O-N 3.14Å; L96-I100 HydrophobicContact CD1-CD1 4.04Å; L96-I100 HydrophobicContact CD1-CG1 4.25Å; L96-I100 HydrophobicContact CG-CD1 3.95Å; L96-I100 WeakPolarHBondContact O-CG1 3.45Å; L96-I100 PolarHBondContact O-N 3.16Å; L96-P190 HydrophobicContact CD2-CB 4.32Å; L96-L193 HydrophobicContact CD1-CB 4.35Å; L96-L193 HydrophobicContact CD1-CD2 3.77Å; L96-L193 HydrophobicContact CD1-CG 3.86Å; L96-L193 HydrophobicContact CD2-CD2 4.07Å; L96-M194 HydrophobicContact CB-CG 4.15Å; L96-M194 HydrophobicContact CB-SD 4.33Å; L96-M194 HydrophobicContact CD1-CG 3.76Å; L96-I197 HydrophobicContact CD1-CD1 4.18Å |
| 97 | A | 92.7 | Very high | 90.1 | Very high | 12 Ų | 12 | 25.1 Ų | 25.1 | 10% | 0.099 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -61.7 | -40.5 | 175 | 0 | 0 | 0 | 0 | 0 | 111.8 | F44 F93 S94 I100 D101 | F44-A97 HydrophobicContact CD1-CB 3.68Å; F44-A97 HydrophobicContact CE1-CB 3.73Å; F44-A97 HydrophobicContact CG-CB 4.2Å; F44-A97 HydrophobicContact CZ-CB 4.29Å; F93-A97 VanDerWaalsContact O-CB 3.31Å; F93-A97 WeakPolarHBondContact O-CB 3.48Å; F93-A97 PolarHBondContact O-N 3Å; S94-A97 PolarHBondContact O-N 3.2Å; A97-I100 PolarHBondContact O-N 2.91Å; A97-D101 WeakPolarHBondContact O-CB 3.28Å; A97-D101 PolarHBondContact O-N 3.42Å |
| 98 | I | 90.1 | Very high | 89.6 | Confident | 17 Ų | 17 | 28.5 Ų | 28.5 | 9% | 0.087 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61.6 | -44 | 171.8 | -68.3 | 162.8 | 0 | 0 | 0 | 110.7 | F44 V45 L48 S94 L95 L96 I100 D101 R102 | F44-I98 HydrophobicContact CB-CD1 4.18Å; F44-I98 HydrophobicContact CB-CG1 3.62Å; V45-I98 HydrophobicContact CG2-CD1 4.02Å; L48-I98 HydrophobicContact CD2-CD1 4.44Å; S94-I98 WeakPolarHBondContact O-CD1 3.42Å; S94-I98 VanDerWaalsContact O-CG1 3.26Å; S94-I98 WeakPolarHBondContact O-CG1 3.49Å; S94-I98 PolarHBondContact O-N 3.44Å; L95-I98 PolarHBondContact O-N 2.99Å; L96-I98 VanDerWaalsContact C-N 3.33Å; L96-I98 PolarHBondContact O-N 3.44Å; I98-I100 PolarHBondContact O-N 2.93Å; I98-D101 PolarHBondContact O-N 3.42Å; I98-R102 HydrophobicContact CG2-CG 4.38Å; I98-R102 WeakPolarHBondContact O-CB 3.32Å; I98-R102 VanDerWaalsContact O-CG 3.28Å; I98-R102 WeakPolarHBondContact O-CG 3.41Å; I98-R102 PolarHBondContact O-N 3.27Å |
| 99 | A | 88.4 | Confident | 89.2 | Confident | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -60.8 | -45.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L95 L96 R102 Y103 M194 I197 Y198 | L95-A99 PolarHBondContact O-N 3.43Å; L96-A99 WeakPolarHBondContact O-CB 3.34Å; L96-A99 PolarHBondContact O-N 2.9Å; L96-A99 VanDerWaalsContact O-N 3.14Å; A99-R102 PolarHBondContact O-N 2.9Å; A99-Y103 WeakPolarHBondContact O-CB 3.31Å; A99-Y103 PolarHBondContact O-N 2.97Å; A99-M194 HydrophobicContact CB-CG 4.08Å; A99-I197 HydrophobicContact CB-CG2 4.15Å; A99-I197 WeakPolarHBondContact O-CG2 3.38Å; A99-Y198 WeakPolarHBondContact CA-OH 3.36Å; A99-Y198 HydrophobicContact CB-CE1 4.25Å; A99-Y198 HydrophobicContact CB-CE2 3.63Å; A99-Y198 WeakPolarHBondContact CB-OH 3.41Å |
| 100 | I | 90.8 | Very high | 88.8 | Confident | 76 Ų | 76 | 40.6 Ų | 40.6 | 39% | 0.39 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -64.7 | -45.7 | 176.8 | -66.3 | 166.6 | 0 | 0 | 0 | 111 | L96 A97 I98 R102 Y103 V104 I197 | L96-I100 HydrophobicContact CD1-CD1 4.04Å; L96-I100 HydrophobicContact CD1-CG1 4.25Å; L96-I100 HydrophobicContact CG-CD1 3.95Å; L96-I100 WeakPolarHBondContact O-CG1 3.45Å; L96-I100 PolarHBondContact O-N 3.16Å; A97-I100 PolarHBondContact O-N 2.91Å; I98-I100 PolarHBondContact O-N 2.93Å; I100-R102 VanDerWaalsContact C-N 3.35Å; I100-R102 PolarHBondContact O-N 3.29Å; I100-Y103 WeakPolarHBondContact O-CB 3.42Å; I100-Y103 PolarHBondContact O-N 3.34Å; I100-Y103 VanDerWaalsContact O-N 3.16Å; I100-V104 HydrophobicContact CG2-CG2 4.46Å; I100-V104 WeakPolarHBondContact O-CG2 3.37Å; I100-V104 PolarHBondContact O-N 2.86Å; I100-I197 HydrophobicContact CG1-CD1 3.73Å |
| 101 | D | 89.7 | Confident | 88.5 | Confident | 7 Ų | 7 | 49 Ų | 49 | 4% | 0.037 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -58.1 | -45.2 | 176.2 | 165.6 | 76.3 | 0 | 0 | 0 | 111.8 | T41 A97 I98 Y103 V104 A105 Y112 | T41-D101 WeakPolarHBondContact CB-OD2 3.35Å; T41-D101 WeakPolarHBondContact CG2-OD2 3.46Å; T41-D101 PolarHBondContact OG1-OD2 2.85Å; A97-D101 WeakPolarHBondContact O-CB 3.28Å; A97-D101 PolarHBondContact O-N 3.42Å; I98-D101 PolarHBondContact O-N 3.42Å; D101-Y103 VanDerWaalsContact C-N 3.35Å; D101-V104 PolarHBondContact O-N 3.38Å; D101-A105 WeakPolarHBondContact O-CB 3.12Å; D101-A105 PolarHBondContact O-N 3.01Å; D101-Y112 VanDerWaalsContact OD1-CE2 3.25Å; D101-Y112 WeakPolarHBondContact OD1-CE2 3.46Å; D101-Y112 PolarHBondContact OD1-OH 2.97Å |
| 102 | R | 85 | Confident | 88.3 | Confident | 66 Ų | 66 | 50.4 Ų | 50.4 | 25% | 0.249 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -66.1 | -35.8 | 175.7 | -64.9 | -59.5 | 80.8 | -152.9 | -5.8 | 112.4 | T41 I98 A99 I100 I106 Y112 L236 | T41-R102 PolarHBondContact OG1-NH2 3.39Å; I98-R102 HydrophobicContact CG2-CG 4.38Å; I98-R102 WeakPolarHBondContact O-CB 3.32Å; I98-R102 VanDerWaalsContact O-CG 3.28Å; I98-R102 WeakPolarHBondContact O-CG 3.41Å; I98-R102 PolarHBondContact O-N 3.27Å; A99-R102 PolarHBondContact O-N 2.9Å; I100-R102 VanDerWaalsContact C-N 3.35Å; I100-R102 PolarHBondContact O-N 3.29Å; R102-I106 WeakPolarHBondContact O-CB 3.49Å; R102-I106 WeakPolarHBondContact O-CD1 3.36Å; R102-I106 VanDerWaalsContact O-CG1 3.28Å; R102-I106 WeakPolarHBondContact O-CG1 3.46Å; R102-I106 PolarHBondContact O-N 3.07Å; R102-I106 VanDerWaalsContact O-N 3.13Å; R102-Y112 PolarHBondContact NH2-OH 3.3Å; R102-L236 HydrophobicContact CB-CD1 4.5Å; R102-L236 HydrophobicContact CG-CD1 4.48Å; R102-L236 HydrophobicContact CG-CD2 4.45Å |
| 103 | Y | 86.3 | Confident | 88 | Confident | 80 Ų | 80 | 56.9 Ų | 56.9 | 31% | 0.314 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61.1 | -52.1 | 173.4 | -180 | -93.4 | 0 | 0 | 0 | 111.9 | A99 I100 D101 A105 I106 K107 I197 C200 I201 | A99-Y103 WeakPolarHBondContact O-CB 3.31Å; A99-Y103 PolarHBondContact O-N 2.97Å; I100-Y103 WeakPolarHBondContact O-CB 3.42Å; I100-Y103 PolarHBondContact O-N 3.34Å; I100-Y103 VanDerWaalsContact O-N 3.16Å; D101-Y103 VanDerWaalsContact C-N 3.35Å; Y103-A105 VanDerWaalsContact C-N 3.33Å; Y103-A105 PolarHBondContact O-N 3.47Å; Y103-I106 PolarHBondContact O-N 3.32Å; Y103-K107 HydrophobicContact CD2-CG 4.13Å; Y103-K107 HydrophobicContact CE1-CB 4.37Å; Y103-K107 HydrophobicContact CE1-CG 4.18Å; Y103-K107 HydrophobicContact CE2-CG 3.76Å; Y103-K107 HydrophobicContact CG-CG 4.47Å; Y103-K107 VanDerWaalsContact O-CB 3.32Å; Y103-K107 WeakPolarHBondContact O-CB 3.28Å; Y103-K107 PolarHBondContact O-N 3.49Å; Y103-I197 HydrophobicContact CD2-CG2 4.06Å; Y103-I197 HydrophobicContact CG-CG2 4.24Å; Y103-C200 HydrophobicContact CE2-CB 3.97Å; Y103-I201 HydrophobicContact CD2-CD1 4.46Å; Y103-I201 HydrophobicContact CD2-CG1 4.01Å |
| 104 | V | 89.3 | Confident | 87.7 | Confident | 25 Ų | 25 | 59.9 Ų | 59.9 | 15% | 0.152 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -63.3 | -40.6 | -179.4 | -179.9 | 0 | 0 | 0 | 0 | 110.8 | I100 D101 I106 I108 Y112 L115 V116 | I100-V104 HydrophobicContact CG2-CG2 4.46Å; I100-V104 WeakPolarHBondContact O-CG2 3.37Å; I100-V104 PolarHBondContact O-N 2.86Å; D101-V104 PolarHBondContact O-N 3.38Å; V104-I106 VanDerWaalsContact C-N 3.34Å; V104-I106 PolarHBondContact O-N 2.82Å; V104-I108 CarbonylContact O-C 3.58Å; V104-I108 WeakPolarHBondContact O-CA 3.42Å; V104-I108 PolarHBondContact O-N 3.06Å; V104-Y112 HydrophobicContact CB-CD2 4.44Å; V104-Y112 HydrophobicContact CG1-CD2 4.12Å; V104-L115 HydrophobicContact CG1-CD1 3.96Å; V104-V116 HydrophobicContact CG1-CG2 4.46Å |
| 105 | A | 84.8 | Confident | 87.4 | Confident | 23 Ų | 23 | 63.5 Ų | 63.5 | 19% | 0.19 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -60.3 | -40 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | D101 Y103 Y112 | D101-A105 WeakPolarHBondContact O-CB 3.12Å; D101-A105 PolarHBondContact O-N 3.01Å; Y103-A105 VanDerWaalsContact C-N 3.33Å; Y103-A105 PolarHBondContact O-N 3.47Å; A105-Y112 VanDerWaalsContact CA-CD2 3.49Å; A105-Y112 HydrophobicContact CB-CD2 3.72Å; A105-Y112 HydrophobicContact CB-CE2 3.68Å; A105-Y112 HydrophobicContact CB-CG 4.33Å |
| 106 | I | 79.1 | Confident | 87.4 | Confident | 52 Ų | 52 | 64.3 Ų | 64.3 | 27% | 0.267 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -84.1 | -39.4 | -177.1 | -65.7 | 168.7 | 0 | 0 | 0 | 111.7 | R102 Y103 V104 I201 | R102-I106 WeakPolarHBondContact O-CB 3.49Å; R102-I106 WeakPolarHBondContact O-CD1 3.36Å; R102-I106 VanDerWaalsContact O-CG1 3.28Å; R102-I106 WeakPolarHBondContact O-CG1 3.46Å; R102-I106 PolarHBondContact O-N 3.07Å; R102-I106 VanDerWaalsContact O-N 3.13Å; Y103-I106 PolarHBondContact O-N 3.32Å; V104-I106 VanDerWaalsContact C-N 3.34Å; V104-I106 PolarHBondContact O-N 2.82Å; I106-I201 HydrophobicContact CD1-CG1 4.48Å; I106-I201 HydrophobicContact CD1-CG2 3.61Å |
| 107 | K | 82 | Confident | 87.4 | Confident | 95 Ų | 95 | 65.3 Ų | 65.3 | 41% | 0.413 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -83.8 | -31.3 | -176.7 | -75.7 | -71.4 | -160.8 | 167.9 | 0 | 114.1 | Y103 P109 A204 | Y103-K107 HydrophobicContact CD2-CG 4.13Å; Y103-K107 HydrophobicContact CE1-CB 4.37Å; Y103-K107 HydrophobicContact CE1-CG 4.18Å; Y103-K107 HydrophobicContact CE2-CG 3.76Å; Y103-K107 HydrophobicContact CG-CG 4.47Å; Y103-K107 VanDerWaalsContact O-CB 3.32Å; Y103-K107 WeakPolarHBondContact O-CB 3.28Å; Y103-K107 PolarHBondContact O-N 3.49Å; K107-P109 VanDerWaalsContact C-CD 3.48Å; K107-A204 HydrophobicContact CD-CB 4.16Å |
| 108 | I | 85.8 | Confident | 87.3 | Confident | 75 Ų | 75 | 67.4 Ų | 67.4 | 39% | 0.385 | 35% | 0.349 | S | S | . | . | trans | -134.9 | 54.6 | -172.9 | -35.5 | -179.9 | 0 | 0 | 0 | 111.2 | V104 L110 R111 Y112 | V104-I108 CarbonylContact O-C 3.58Å; V104-I108 WeakPolarHBondContact O-CA 3.42Å; V104-I108 PolarHBondContact O-N 3.06Å; I108-L110 VanDerWaalsContact C-N 3.28Å; I108-L110 PolarHBondContact O-N 3.5Å; I108-R111 HydrophobicContact CG2-CB 3.83Å; I108-R111 HydrophobicContact CG2-CG 4.17Å; I108-R111 PolarHBondContact O-N 3.39Å; I108-R111 VanDerWaalsContact O-N 3.09Å; I108-Y112 PolarHBondContact O-N 2.83Å; I108-Y112 VanDerWaalsContact O-N 3.07Å | ||
| 109 | P | 84.2 | Confident | 87.3 | Confident | 83 Ų | 83 | 74.7 Ų | 74.7 | 54% | 0.539 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -57.2 | -38.3 | -172.5 | 22.9 | -34.3 | 0 | 0 | 0 | 113.1 | K107 R111 Y112 | K107-P109 VanDerWaalsContact C-CD 3.48Å; P109-R111 VanDerWaalsContact C-N 3.29Å; P109-R111 PolarHBondContact O-N 3.5Å; P109-Y112 WeakPolarHBondContact O-CB 3.32Å; P109-Y112 PolarHBondContact O-N 2.99Å |
| 110 | L | 86.5 | Confident | 87.6 | Confident | 174 Ų | 174 | 81.6 Ų | 81.6 | 91% | 0.911 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -65.3 | -26.1 | -179 | -62.4 | 178.2 | 0 | 0 | 0 | 114.2 | I108 | I108-L110 VanDerWaalsContact C-N 3.28Å; I108-L110 PolarHBondContact O-N 3.5Å |
| 111 | R | 89.2 | Confident | 87.7 | Confident | 178 Ų | 178 | 78.1 Ų | 78.1 | 67% | 0.672 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -105.4 | -7.8 | 178.2 | -62.4 | -173.3 | 175.7 | -174.6 | -1.1 | 113.3 | I108 P109 N113 S114 L115 | I108-R111 HydrophobicContact CG2-CB 3.83Å; I108-R111 HydrophobicContact CG2-CG 4.17Å; I108-R111 PolarHBondContact O-N 3.39Å; I108-R111 VanDerWaalsContact O-N 3.09Å; P109-R111 VanDerWaalsContact C-N 3.29Å; P109-R111 PolarHBondContact O-N 3.5Å; R111-N113 VanDerWaalsContact C-N 3.35Å; R111-N113 PolarHBondContact O-N 3.16Å; R111-S114 PolarHBondContact O-N 3.42Å; R111-L115 HydrophobicContact CB-CD1 3.91Å; R111-L115 HydrophobicContact CB-CG 4.27Å; R111-L115 WeakPolarHBondContact O-CG 3.28Å; R111-L115 PolarHBondContact O-N 2.89Å |
| 112 | Y | 88.8 | Confident | 87.9 | Confident | 32 Ų | 32 | 86.1 Ų | 86.1 | 13% | 0.125 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -50.1 | -51.1 | -176.2 | 177.8 | -101 | 0 | 0 | 0 | 112.5 | D101 R102 V104 A105 I108 P109 S114 L115 V116 | D101-Y112 VanDerWaalsContact OD1-CE2 3.25Å; D101-Y112 WeakPolarHBondContact OD1-CE2 3.46Å; D101-Y112 PolarHBondContact OD1-OH 2.97Å; R102-Y112 PolarHBondContact NH2-OH 3.3Å; V104-Y112 HydrophobicContact CB-CD2 4.44Å; V104-Y112 HydrophobicContact CG1-CD2 4.12Å; A105-Y112 VanDerWaalsContact CA-CD2 3.49Å; A105-Y112 HydrophobicContact CB-CD2 3.72Å; A105-Y112 HydrophobicContact CB-CE2 3.68Å; A105-Y112 HydrophobicContact CB-CG 4.33Å; I108-Y112 PolarHBondContact O-N 2.83Å; I108-Y112 VanDerWaalsContact O-N 3.07Å; P109-Y112 WeakPolarHBondContact O-CB 3.32Å; P109-Y112 PolarHBondContact O-N 2.99Å; Y112-S114 PolarHBondContact O-N 3.1Å; Y112-S114 VanDerWaalsContact O-N 3.15Å; Y112-L115 PolarHBondContact O-N 3.13Å; Y112-V116 HydrophobicContact CD2-CB 4.16Å; Y112-V116 HydrophobicContact CD2-CG2 3.83Å; Y112-V116 HydrophobicContact CE2-CB 3.79Å; Y112-V116 HydrophobicContact CE2-CG1 4.04Å; Y112-V116 HydrophobicContact CE2-CG2 3.57Å; Y112-V116 PolarHBondContact O-N 2.81Å |
| 113 | N | 86.1 | Confident | 88.4 | Confident | 137 Ų | 137 | 85 Ų | 85 | 73% | 0.733 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -65 | -18.2 | -178.4 | -63.9 | -25.9 | 0 | 0 | 0 | 114.7 | R111 | R111-N113 VanDerWaalsContact C-N 3.35Å; R111-N113 PolarHBondContact O-N 3.16Å |
| 114 | S | 88.2 | Confident | 88.7 | Confident | 92 Ų | 92 | 84 Ų | 84 | 64% | 0.643 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -95 | -30.7 | 176.9 | 178.3 | 0 | 0 | 0 | 0 | 112.2 | R111 Y112 R120 | R111-S114 PolarHBondContact O-N 3.42Å; Y112-S114 PolarHBondContact O-N 3.1Å; Y112-S114 VanDerWaalsContact O-N 3.15Å; S114-R120 PolarHBondContact O-NH1 3.14Å |
| 115 | L | 87.7 | Confident | 89.1 | Confident | 78 Ų | 78 | 84.2 Ų | 84.2 | 41% | 0.408 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -80.4 | -53.6 | 177.8 | -67.4 | 171.3 | 0 | 0 | 0 | 111.5 | V104 R111 Y112 R120 | V104-L115 HydrophobicContact CG1-CD1 3.96Å; R111-L115 HydrophobicContact CB-CD1 3.91Å; R111-L115 HydrophobicContact CB-CG 4.27Å; R111-L115 WeakPolarHBondContact O-CG 3.28Å; R111-L115 PolarHBondContact O-N 2.89Å; Y112-L115 PolarHBondContact O-N 3.13Å; L115-R120 WeakPolarHBondContact O-CD 3.26Å; L115-R120 PolarHBondContact O-NH1 3.18Å |
| 116 | V | 88.8 | Confident | 89.7 | Confident | 26 Ų | 26 | 86 Ų | 86 | 16% | 0.158 | 45% | 0.448 | C | S | . | . | S | Bend | trans | -93.7 | 104.6 | -175.2 | 179.5 | 0 | 0 | 0 | 0 | 108.6 | I40 V104 Y112 | I40-V116 HydrophobicContact CB-CG1 4.05Å; I40-V116 HydrophobicContact CD1-CG1 4.08Å; I40-V116 WeakPolarHBondContact CD1-O 3.33Å; I40-V116 HydrophobicContact CG2-CG1 3.59Å; V104-V116 HydrophobicContact CG1-CG2 4.46Å; Y112-V116 HydrophobicContact CD2-CB 4.16Å; Y112-V116 HydrophobicContact CD2-CG2 3.83Å; Y112-V116 HydrophobicContact CE2-CB 3.79Å; Y112-V116 HydrophobicContact CE2-CG1 4.04Å; Y112-V116 HydrophobicContact CE2-CG2 3.57Å; Y112-V116 PolarHBondContact O-N 2.81Å |
| 117 | T | 92.5 | Very high | 90.5 | Very high | 44 Ų | 44 | 89.9 Ų | 89.9 | 27% | 0.27 | 46% | 0.463 | S | S | . | . | trans | -124.1 | 151.8 | -179.2 | 72.3 | 0 | 0 | 0 | 0 | 110.8 | Q119 R120 A121 | T117-Q119 VanDerWaalsContact C-N 3.27Å; T117-Q119 PolarHBondContact O-N 3.4Å; T117-R120 PolarHBondContact O-N 3.25Å; T117-R120 VanDerWaalsContact O-N 3.14Å; T117-R120 WeakPolarHBondContact OG1-CG 3.44Å; T117-R120 PolarHBondContact OG1-N 3.17Å; T117-A121 PolarHBondContact O-N 3.36Å | ||
| 118 | S | 89.3 | Confident | 91.2 | Very high | 56 Ų | 56 | 85.8 Ų | 85.8 | 39% | 0.392 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -59.6 | -33.9 | -176.3 | -52.2 | 0 | 0 | 0 | 0 | 113.7 | R122 | S118-R122 WeakPolarHBondContact O-CG 3.42Å; S118-R122 PolarHBondContact O-N 3.07Å; S118-R122 VanDerWaalsContact O-N 3.1Å |
| 119 | Q | 91.9 | Very high | 91.8 | Very high | 169 Ų | 169 | 85.5 Ų | 85.5 | 79% | 0.79 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -67.7 | -47.2 | 175.3 | -71.6 | -178.9 | -11.2 | 0 | 0 | 111.5 | T117 A121 R122 G123 | T117-Q119 VanDerWaalsContact C-N 3.27Å; T117-Q119 PolarHBondContact O-N 3.4Å; Q119-A121 PolarHBondContact O-N 2.61Å; Q119-R122 PolarHBondContact O-N 3.26Å; Q119-G123 PolarHBondContact O-N 3.11Å |
| 120 | R | 93.1 | Very high | 92.5 | Very high | 145 Ų | 145 | 83.9 Ų | 83.9 | 55% | 0.547 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -61.2 | -44.3 | 176.5 | -72.7 | 178.2 | -179.9 | 150.3 | 3 | 111.2 | S114 L115 T117 R122 G123 T124 | S114-R120 PolarHBondContact O-NH1 3.14Å; L115-R120 WeakPolarHBondContact O-CD 3.26Å; L115-R120 PolarHBondContact O-NH1 3.18Å; T117-R120 PolarHBondContact O-N 3.25Å; T117-R120 VanDerWaalsContact O-N 3.14Å; T117-R120 WeakPolarHBondContact OG1-CG 3.44Å; T117-R120 PolarHBondContact OG1-N 3.17Å; R120-R122 PolarHBondContact O-N 2.84Å; R120-G123 CarbonylContact O-C 3.44Å; R120-G123 WeakPolarHBondContact O-CA 3.33Å; R120-G123 PolarHBondContact O-N 3.04Å; R120-G123 VanDerWaalsContact O-N 3.12Å; R120-T124 PolarHBondContact O-N 3.27Å; R120-T124 PolarHBondContact O-OG1 2.91Å; R120-T124 VanDerWaalsContact O-OG1 3.07Å |
| 121 | A | 92.6 | Very high | 92.9 | Very high | 4 Ų | 4 | 78 Ų | 78 | 3% | 0.033 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -61.3 | -41.8 | 178 | 0 | 0 | 0 | 0 | 0 | 113 | I40 F44 T117 Q119 G123 T124 I125 | I40-A121 HydrophobicContact CG2-CB 3.4Å; I40-A121 VanDerWaalsContact CG2-CB 3.4Å; F44-A121 HydrophobicContact CE2-CB 4.05Å; F44-A121 HydrophobicContact CZ-CB 3.85Å; T117-A121 PolarHBondContact O-N 3.36Å; Q119-A121 PolarHBondContact O-N 2.61Å; A121-G123 VanDerWaalsContact C-N 3.35Å; A121-T124 PolarHBondContact O-N 3.2Å; A121-I125 VanDerWaalsContact O-CG1 3.31Å; A121-I125 WeakPolarHBondContact O-CG1 3.41Å; A121-I125 PolarHBondContact O-N 3.35Å |
| 122 | R | 93.8 | Very high | 93.3 | Very high | 175 Ų | 175 | 69.5 Ų | 69.5 | 66% | 0.66 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -61.3 | -41.8 | 172 | -75.7 | 178.2 | 175.9 | -173.5 | -2 | 112.1 | S118 Q119 R120 I125 A126 | S118-R122 WeakPolarHBondContact O-CG 3.42Å; S118-R122 PolarHBondContact O-N 3.07Å; S118-R122 VanDerWaalsContact O-N 3.1Å; Q119-R122 PolarHBondContact O-N 3.26Å; R120-R122 PolarHBondContact O-N 2.84Å; R122-I125 PolarHBondContact O-N 2.83Å; R122-A126 PolarHBondContact O-N 3.47Å |
| 123 | G | 95.6 | Very high | 93.7 | Very high | 43 Ų | 43 | 71.8 Ų | 71.8 | 44% | 0.443 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -61.7 | -44.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q119 R120 A121 A126 F127 | Q119-G123 PolarHBondContact O-N 3.11Å; R120-G123 CarbonylContact O-C 3.44Å; R120-G123 WeakPolarHBondContact O-CA 3.33Å; R120-G123 PolarHBondContact O-N 3.04Å; R120-G123 VanDerWaalsContact O-N 3.12Å; A121-G123 VanDerWaalsContact C-N 3.35Å; G123-A126 PolarHBondContact O-N 3.4Å; G123-F127 WeakPolarHBondContact O-CB 3.19Å; G123-F127 PolarHBondContact O-N 2.85Å |
| 124 | T | 94.5 | Very high | 94.2 | Very high | 58 Ų | 58 | 69.6 Ų | 69.6 | 36% | 0.356 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -61.1 | -45 | 174.6 | -54.9 | 0 | 0 | 0 | 0 | 111.4 | F44 R120 A121 F127 C128 | F44-T124 HydrophobicContact CE1-CG2 3.86Å; F44-T124 HydrophobicContact CZ-CG2 4.26Å; R120-T124 PolarHBondContact O-N 3.27Å; R120-T124 PolarHBondContact O-OG1 2.91Å; R120-T124 VanDerWaalsContact O-OG1 3.07Å; A121-T124 PolarHBondContact O-N 3.2Å; T124-F127 PolarHBondContact O-N 2.97Å; T124-C128 PolarHBondContact O-N 3.26Å; T124-C128 PolarHBondContact O-SG 3.01Å |
| 125 | I | 96.7 | Very high | 94.6 | Very high | 29 Ų | 29 | 65.9 Ų | 65.9 | 15% | 0.149 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -59.8 | -48.6 | 176.5 | -70.6 | 164.1 | 0 | 0 | 0 | 110.7 | F43 F44 A121 R122 F127 C128 W129 | F43-I125 HydrophobicContact CB-CD1 3.91Å; F44-I125 HydrophobicContact CD1-CD1 4.08Å; F44-I125 HydrophobicContact CD1-CG1 3.64Å; F44-I125 HydrophobicContact CE1-CD1 4.33Å; F44-I125 HydrophobicContact CE1-CG1 3.76Å; A121-I125 VanDerWaalsContact O-CG1 3.31Å; A121-I125 WeakPolarHBondContact O-CG1 3.41Å; A121-I125 PolarHBondContact O-N 3.35Å; R122-I125 PolarHBondContact O-N 2.83Å; I125-F127 VanDerWaalsContact C-N 3.31Å; I125-F127 PolarHBondContact O-N 3.26Å; I125-C128 PolarHBondContact O-N 2.91Å; I125-W129 PolarHBondContact O-N 3.32Å |
| 126 | A | 97.1 | Very high | 94.9 | Very high | 62 Ų | 62 | 62.2 Ų | 62.2 | 51% | 0.512 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -60.4 | -40.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112.3 | R122 G123 A130 | R122-A126 PolarHBondContact O-N 3.47Å; G123-A126 PolarHBondContact O-N 3.4Å; A126-A130 WeakPolarHBondContact O-CB 3.4Å; A126-A130 PolarHBondContact O-N 3.09Å |
| 127 | F | 96.5 | Very high | 95.3 | Very high | 132 Ų | 132 | 62.7 Ų | 62.7 | 58% | 0.579 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -63.4 | -44.2 | 173.9 | 175 | -99.4 | 0 | 0 | 0 | 112.4 | G123 T124 I125 A130 L131 | G123-F127 WeakPolarHBondContact O-CB 3.19Å; G123-F127 PolarHBondContact O-N 2.85Å; T124-F127 PolarHBondContact O-N 2.97Å; I125-F127 VanDerWaalsContact C-N 3.31Å; I125-F127 PolarHBondContact O-N 3.26Å; F127-A130 PolarHBondContact O-N 2.86Å; F127-L131 HydrophobicContact CE1-CD2 3.89Å; F127-L131 HydrophobicContact CZ-CD2 3.92Å; F127-L131 VanDerWaalsContact O-CB 3.28Å; F127-L131 WeakPolarHBondContact O-CB 3.47Å; F127-L131 PolarHBondContact O-N 3.36Å |
| 128 | C | 97 | Very high | 95.4 | Very high | 10 Ų | 10 | 61.7 Ų | 61.7 | 7% | 0.068 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -58.1 | -50 | 175.9 | -67.8 | 0 | 0 | 0 | 0 | 111.2 | F93 T124 I125 A130 L131 S132 | F93-C128 HydrophobicContact CB-CB 3.88Å; F93-C128 HydrophobicContact CD2-CB 4.41Å; T124-C128 PolarHBondContact O-N 3.26Å; T124-C128 PolarHBondContact O-SG 3.01Å; I125-C128 PolarHBondContact O-N 2.91Å; C128-A130 PolarHBondContact O-N 2.94Å; C128-L131 PolarHBondContact O-N 2.87Å; C128-S132 WeakPolarHBondContact O-CB 3.31Å; C128-S132 PolarHBondContact O-N 2.77Å; C128-S132 PolarHBondContact O-OG 3.28Å |
| 129 | W | 97.9 | Very high | 95.6 | Very high | 68 Ų | 68 | 59 Ų | 59 | 26% | 0.258 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -59.5 | -47.2 | 177.1 | -84.2 | 94.3 | 0 | 0 | 0 | 112.5 | S47 V50 A51 L87 N90 I125 S132 I133 | S47-W129 PolarHBondContact OG-NE1 3.36Å; S47-W129 VanDerWaalsContact OG-NE1 3.15Å; V50-W129 HydrophobicContact CG1-CH2 4.39Å; V50-W129 HydrophobicContact CG1-CZ2 3.99Å; A51-W129 HydrophobicContact CB-CH2 4.36Å; A51-W129 HydrophobicContact CB-CZ2 4.35Å; L87-W129 HydrophobicContact CD2-CH2 4.19Å; L87-W129 HydrophobicContact CD2-CZ3 4.1Å; N90-W129 WeakPolarHBondContact ND2-CZ2 3.06Å; N90-W129 PolarHBondContact ND2-NE1 3.46Å; I125-W129 PolarHBondContact O-N 3.32Å; W129-S132 PolarHBondContact O-N 3.36Å; W129-I133 VanDerWaalsContact O-CG1 3.32Å; W129-I133 WeakPolarHBondContact O-CG1 3.4Å; W129-I133 PolarHBondContact O-N 3.43Å |
| 130 | A | 97.9 | Very high | 95.6 | Very high | 49 Ų | 49 | 54 Ų | 54 | 41% | 0.405 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -61.2 | -46.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | A126 F127 C128 S132 I133 I134 | A126-A130 WeakPolarHBondContact O-CB 3.4Å; A126-A130 PolarHBondContact O-N 3.09Å; F127-A130 PolarHBondContact O-N 2.86Å; C128-A130 PolarHBondContact O-N 2.94Å; A130-S132 VanDerWaalsContact C-N 3.34Å; A130-S132 PolarHBondContact O-N 3.16Å; A130-I133 PolarHBondContact O-N 3.23Å; A130-I134 WeakPolarHBondContact O-CG1 3.49Å; A130-I134 PolarHBondContact O-N 3.17Å; A130-I134 VanDerWaalsContact O-N 3.09Å |
| 131 | L | 96.8 | Very high | 95.5 | Very high | 51 Ų | 51 | 54.1 Ų | 54.1 | 27% | 0.267 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -65.2 | -37.4 | 178.2 | -174.9 | 60 | 0 | 0 | 0 | 111.8 | F93 F127 C128 I134 I135 | F93-L131 HydrophobicContact CD2-CD2 4.46Å; F93-L131 HydrophobicContact CE1-CD2 4.36Å; F93-L131 HydrophobicContact CE2-CB 3.97Å; F93-L131 HydrophobicContact CE2-CD2 3.6Å; F93-L131 HydrophobicContact CE2-CG 3.62Å; F93-L131 HydrophobicContact CZ-CD2 3.53Å; F93-L131 HydrophobicContact CZ-CG 3.89Å; F127-L131 HydrophobicContact CE1-CD2 3.89Å; F127-L131 HydrophobicContact CZ-CD2 3.92Å; F127-L131 VanDerWaalsContact O-CB 3.28Å; F127-L131 WeakPolarHBondContact O-CB 3.47Å; F127-L131 PolarHBondContact O-N 3.36Å; C128-L131 PolarHBondContact O-N 2.87Å; L131-I134 PolarHBondContact O-N 2.96Å; L131-I135 HydrophobicContact CD1-CD1 3.98Å; L131-I135 HydrophobicContact CD1-CG1 4.3Å; L131-I135 HydrophobicContact CD2-CD1 4.48Å; L131-I135 HydrophobicContact CG-CD1 3.8Å; L131-I135 HydrophobicContact CG-CG1 4.49Å; L131-I135 WeakPolarHBondContact O-CB 3.46Å; L131-I135 VanDerWaalsContact O-CG1 3.31Å; L131-I135 WeakPolarHBondContact O-CG1 3.1Å; L131-I135 PolarHBondContact O-N 2.97Å |
| 132 | S | 97.6 | Very high | 95.3 | Very high | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65.3 | -38.3 | 174.8 | -64.1 | 0 | 0 | 0 | 0 | 113.4 | V86 Q89 N90 F93 C128 W129 A130 G136 | V86-S132 WeakPolarHBondContact O-CB 3.47Å; Q89-S132 VanDerWaalsContact C-OG 3.23Å; Q89-S132 PolarHBondContact O-OG 3.13Å; N90-S132 WeakPolarHBondContact CA-OG 3.37Å; N90-S132 WeakPolarHBondContact CB-OG 3.43Å; N90-S132 PolarHBondContact N-OG 3.32Å; F93-S132 VanDerWaalsContact CD2-OG 3.29Å; F93-S132 WeakPolarHBondContact CD2-OG 3.48Å; C128-S132 WeakPolarHBondContact O-CB 3.31Å; C128-S132 PolarHBondContact O-N 2.77Å; C128-S132 PolarHBondContact O-OG 3.28Å; W129-S132 PolarHBondContact O-N 3.36Å; A130-S132 VanDerWaalsContact C-N 3.34Å; A130-S132 PolarHBondContact O-N 3.16Å; S132-G136 PolarHBondContact O-N 3.36Å |
| 133 | I | 97.1 | Very high | 95 | Very high | 80 Ų | 80 | 52.8 Ų | 52.8 | 41% | 0.41 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -63.6 | -46.8 | 174.1 | -69.1 | 163.5 | 0 | 0 | 0 | 110 | V86 W129 A130 L137 | V86-I133 HydrophobicContact CG1-CB 4.42Å; V86-I133 HydrophobicContact CG1-CG1 3.72Å; W129-I133 VanDerWaalsContact O-CG1 3.32Å; W129-I133 WeakPolarHBondContact O-CG1 3.4Å; W129-I133 PolarHBondContact O-N 3.43Å; A130-I133 PolarHBondContact O-N 3.23Å; I133-L137 HydrophobicContact CG2-CD1 3.93Å; I133-L137 HydrophobicContact CG2-CG 4.44Å; I133-L137 VanDerWaalsContact O-CB 3.29Å; I133-L137 WeakPolarHBondContact O-CB 3.47Å; I133-L137 WeakPolarHBondContact O-CG 3.45Å; I133-L137 PolarHBondContact O-N 3.05Å |
| 134 | I | 96.3 | Very high | 94.5 | Very high | 91 Ų | 91 | 52.2 Ų | 52.2 | 47% | 0.467 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -60.3 | -50.8 | 178.2 | -66.2 | 163.6 | 0 | 0 | 0 | 110.9 | A130 L131 T138 | A130-I134 WeakPolarHBondContact O-CG1 3.49Å; A130-I134 PolarHBondContact O-N 3.17Å; A130-I134 VanDerWaalsContact O-N 3.09Å; L131-I134 PolarHBondContact O-N 2.96Å; I134-T138 PolarHBondContact O-N 3.35Å; I134-T138 PolarHBondContact O-OG1 3.37Å |
| 135 | I | 95.6 | Very high | 93.7 | Very high | 14 Ų | 14 | 53.3 Ų | 53.3 | 7% | 0.072 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -64.1 | -48.2 | -178.7 | -72 | 170.4 | 0 | 0 | 0 | 111.5 | Q89 F93 L131 T138 Y177 F181 C186 | Q89-I135 HydrophobicContact CG-CB 4.23Å; Q89-I135 HydrophobicContact CG-CD1 4.13Å; Q89-I135 HydrophobicContact CG-CG2 3.97Å; F93-I135 HydrophobicContact CE2-CD1 4.03Å; F93-I135 HydrophobicContact CZ-CD1 3.69Å; L131-I135 HydrophobicContact CD1-CD1 3.98Å; L131-I135 HydrophobicContact CD1-CG1 4.3Å; L131-I135 HydrophobicContact CD2-CD1 4.48Å; L131-I135 HydrophobicContact CG-CD1 3.8Å; L131-I135 HydrophobicContact CG-CG1 4.49Å; L131-I135 WeakPolarHBondContact O-CB 3.46Å; L131-I135 VanDerWaalsContact O-CG1 3.31Å; L131-I135 WeakPolarHBondContact O-CG1 3.1Å; L131-I135 PolarHBondContact O-N 2.97Å; I135-T138 WeakPolarHBondContact O-CB 3.34Å; I135-T138 PolarHBondContact O-N 3.25Å; I135-T138 PolarHBondContact O-OG1 3.36Å; I135-Y177 PolarHBondContact O-OH 2.91Å; I135-F181 HydrophobicContact CB-CE1 4.42Å; I135-F181 HydrophobicContact CG1-CE1 4.39Å; I135-F181 HydrophobicContact CG1-CZ 4.31Å; I135-F181 HydrophobicContact CG2-CE1 3.93Å; I135-C186 HydrophobicContact CG2-CB 4.13Å |
| 136 | G | 95.3 | Very high | 92.5 | Very high | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -71.1 | -34.2 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | C82 S132 | C82-G136 WeakPolarHBondContact CB-O 3.47Å; S132-G136 PolarHBondContact O-N 3.36Å |
| 137 | L | 95.7 | Very high | 90.6 | Very high | 36 Ų | 36 | 57.1 Ų | 57.1 | 19% | 0.188 | 30% | 0.303 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.1 | 6.2 | 177.3 | -54.3 | -173.3 | 0 | 0 | 0 | 113.7 | C82 V86 I133 P139 M140 | C82-L137 HydrophobicContact CB-CD2 3.82Å; V86-L137 HydrophobicContact CG2-CD2 3.72Å; V86-L137 HydrophobicContact CG2-CG 3.81Å; I133-L137 HydrophobicContact CG2-CD1 3.93Å; I133-L137 HydrophobicContact CG2-CG 4.44Å; I133-L137 VanDerWaalsContact O-CB 3.29Å; I133-L137 WeakPolarHBondContact O-CB 3.47Å; I133-L137 WeakPolarHBondContact O-CG 3.45Å; I133-L137 PolarHBondContact O-N 3.05Å; L137-P139 VanDerWaalsContact C-N 3.27Å; L137-M140 HydrophobicContact CB-SD 4.37Å; L137-M140 HydrophobicContact CD1-SD 4.49Å; L137-M140 HydrophobicContact CD2-SD 3.99Å; L137-M140 WeakPolarHBondContact O-CA 3.32Å; L137-M140 VanDerWaalsContact O-CB 3.32Å; L137-M140 WeakPolarHBondContact O-CB 3.33Å; L137-M140 PolarHBondContact O-N 3Å |
| 138 | T | 95.1 | Very high | 88.5 | Confident | 23 Ų | 23 | 57 Ų | 57 | 14% | 0.141 | 31% | 0.308 | C | S | . | . | G | 310 helix | trans | -49.8 | -38 | 175.3 | -69.9 | 0 | 0 | 0 | 0 | 113.6 | I134 I135 M140 M141 W143 Y177 F181 | I134-T138 PolarHBondContact O-N 3.35Å; I134-T138 PolarHBondContact O-OG1 3.37Å; I135-T138 WeakPolarHBondContact O-CB 3.34Å; I135-T138 PolarHBondContact O-N 3.25Å; I135-T138 PolarHBondContact O-OG1 3.36Å; T138-M140 VanDerWaalsContact C-N 3.26Å; T138-M140 PolarHBondContact O-N 2.93Å; T138-M141 WeakPolarHBondContact O-CB 3.45Å; T138-M141 PolarHBondContact O-N 3.46Å; T138-W143 HydrophobicContact CG2-CB 4.48Å; T138-W143 HydrophobicContact CG2-CE3 4.03Å; T138-Y177 HydrophobicContact CG2-CD2 4.18Å; T138-Y177 HydrophobicContact CG2-CE2 3.85Å; T138-F181 HydrophobicContact CG2-CE1 4.45Å |
| 139 | P | 93.3 | Very high | 86.2 | Confident | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 34% | 0.344 | C | S | . | . | G | 310 helix | trans | -60.1 | -33.1 | 174.3 | -27.3 | 38.5 | 0 | 0 | 0 | 113.5 | L78 L137 M141 G142 W143 H144 Y177 | L78-P139 HydrophobicContact CD1-CB 4Å; L137-P139 VanDerWaalsContact C-N 3.27Å; P139-M141 PolarHBondContact O-N 2.92Å; P139-G142 PolarHBondContact O-N 2.9Å; P139-G142 VanDerWaalsContact O-N 3.13Å; P139-W143 PolarHBondContact O-N 3.32Å; P139-H144 HydrophobicContact CB-CB 4.44Å; P139-H144 WeakPolarHBondContact O-CB 3.4Å; P139-H144 PolarHBondContact O-CD2 3.14Å; P139-Y177 HydrophobicContact CG-CD1 3.76Å; P139-Y177 HydrophobicContact CG-CD2 4.16Å; P139-Y177 HydrophobicContact CG-CE1 3.49Å; P139-Y177 VanDerWaalsContact CG-CE1 3.49Å; P139-Y177 HydrophobicContact CG-CE2 3.9Å; P139-Y177 HydrophobicContact CG-CG 4.11Å |
| 140 | M | 92.1 | Very high | 83.5 | Confident | 65 Ų | 65 | 64.4 Ų | 64.4 | 32% | 0.32 | 37% | 0.366 | S | S | . | . | G | 310 helix | trans | -68.9 | -17.7 | 175.2 | -59.5 | -176.1 | 68.3 | 0 | 0 | 113.2 | L78 F79 L137 T138 G142 | L78-M140 HydrophobicContact CD2-CB 4.44Å; L78-M140 HydrophobicContact CD2-CG 3.94Å; L78-M140 HydrophobicContact CG-CG 4.01Å; F79-M140 HydrophobicContact CB-CE 4.05Å; F79-M140 HydrophobicContact CB-SD 4.03Å; F79-M140 HydrophobicContact CD2-CE 4.28Å; F79-M140 HydrophobicContact CD2-SD 3.92Å; F79-M140 HydrophobicContact CG-SD 4.49Å; L137-M140 HydrophobicContact CB-SD 4.37Å; L137-M140 HydrophobicContact CD1-SD 4.49Å; L137-M140 HydrophobicContact CD2-SD 3.99Å; L137-M140 WeakPolarHBondContact O-CA 3.32Å; L137-M140 VanDerWaalsContact O-CB 3.32Å; L137-M140 WeakPolarHBondContact O-CB 3.33Å; L137-M140 PolarHBondContact O-N 3Å; T138-M140 VanDerWaalsContact C-N 3.26Å; T138-M140 PolarHBondContact O-N 2.93Å; M140-G142 PolarHBondContact O-N 3.41Å |
| 141 | M | 90.9 | Very high | 80.9 | Confident | 147 Ų | 147 | 70.1 Ų | 70.1 | 72% | 0.724 | 38% | 0.384 | S | S | * | . | G | 310 helix | trans | -83.2 | 3.8 | 173.3 | -61.5 | -178.5 | 163.6 | 0 | 0 | 113.2 | T138 P139 | T138-M141 WeakPolarHBondContact O-CB 3.45Å; T138-M141 PolarHBondContact O-N 3.46Å; P139-M141 PolarHBondContact O-N 2.92Å |
| 142 | G | 87.7 | Confident | 78.5 | Confident | 46 Ų | 46 | 74.2 Ų | 74.2 | 47% | 0.474 | 41% | 0.412 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 124 | -10.2 | 173 | 0 | 0 | 0 | 0 | 0 | 115 | P139 M140 H144 | P139-G142 PolarHBondContact O-N 2.9Å; P139-G142 VanDerWaalsContact O-N 3.13Å; M140-G142 PolarHBondContact O-N 3.41Å; G142-H144 PolarHBondContact O-N 3.36Å |
| 143 | W | 87.9 | Confident | 75.8 | Confident | 105 Ų | 105 | 80.5 Ų | 80.5 | 40% | 0.398 | 45% | 0.445 | S | S | . | . | trans | -84.1 | 50.7 | 177.7 | -156.6 | -9.5 | 0 | 0 | 0 | 112.4 | T138 P139 Y177 F181 | T138-W143 HydrophobicContact CG2-CB 4.48Å; T138-W143 HydrophobicContact CG2-CE3 4.03Å; P139-W143 PolarHBondContact O-N 3.32Å; W143-Y177 HydrophobicContact CD2-CD2 4.23Å; W143-Y177 HydrophobicContact CE3-CD2 4.05Å; W143-F181 HydrophobicContact CH2-CB 4.2Å; W143-F181 HydrophobicContact CZ3-CB 4.19Å; W143-F181 HydrophobicContact CZ3-CD2 4.44Å; W143-F181 HydrophobicContact CZ3-CG 4.28Å | ||
| 144 | H | 85.8 | Confident | 73.7 | Confident | 30 Ų | 30 | 83.9 Ų | 83.9 | 14% | 0.139 | 46% | 0.464 | C | S | . | . | B | Isolated β-bridge | trans | -121.9 | 156.6 | -177.5 | 58 | 41.9 | 0 | 0 | 0 | 111.6 | F74 Y75 L78 P139 G142 V146 | F74-H144 HydrophobicContact CE1-CB 4.46Å; F74-H144 AromaticContact CE1-CD2 3.7Å; F74-H144 AromaticContact CE1-CE1 3.93Å; F74-H144 AromaticContact CE1-CG 3.8Å; F74-H144 AromaticContact CE1-ND1 3.94Å; F74-H144 AromaticContact CE1-NE2 3.79Å; F74-H144 HydrophobicContact CZ-CB 3.95Å; F74-H144 AromaticContact CZ-CG 3.67Å; F74-H144 AromaticContact CZ-ND1 3.78Å; Y75-H144 AromaticContact CE1-NE2 3.83Å; L78-H144 HydrophobicContact CD1-CB 4.15Å; L78-H144 HydrophobicContact CD2-CB 3.74Å; P139-H144 HydrophobicContact CB-CB 4.44Å; P139-H144 WeakPolarHBondContact O-CB 3.4Å; P139-H144 PolarHBondContact O-CD2 3.14Å; G142-H144 PolarHBondContact O-N 3.36Å; H144-V146 PolarHBondContact O-N 2.92Å |
| 145 | K | 77.6 | Confident | 71.2 | Confident | 81 Ų | 81 | 85 Ų | 85 | 35% | 0.352 | 48% | 0.48 | S | S | . | . | trans | -75.4 | 112.5 | 172.3 | -71.7 | 179.5 | -179.3 | 173.1 | 0 | 109.5 | F74 S147 E170 A171 V172 V173 N174 | F74-K145 WeakPolarHBondContact CE2-O 3.43Å; F74-K145 VanDerWaalsContact CZ-O 3.27Å; F74-K145 WeakPolarHBondContact CZ-O 3.36Å; K145-S147 PolarHBondContact O-N 3.43Å; K145-E170 PolarHBondContact NZ-O 2.99Å; K145-A171 WeakPolarHBondContact CB-O 3.49Å; K145-V172 PolarHBondContact N-O 2.88Å; K145-V172 VanDerWaalsContact N-O 3.09Å; K145-V173 WeakPolarHBondContact CE-O 3.43Å; K145-N174 HydrophobicContact CG-CB 4.42Å | ||
| 146 | V | 70.8 | Confident | 69 | Low | 103 Ų | 103 | 90.2 Ų | 90.2 | 62% | 0.624 | 51% | 0.508 | S | S | * | . | trans | -74.7 | 115.9 | 166.3 | -179.7 | 0 | 0 | 0 | 0 | 107.5 | H144 N148 | H144-V146 PolarHBondContact O-N 2.92Å; V146-N148 PolarHBondContact O-N 2.97Å; V146-N148 VanDerWaalsContact O-N 3.11Å | ||
| 147 | S | 57.7 | Low | 67 | Low | 69 Ų | 69 | 98.4 Ų | 98.4 | 48% | 0.483 | 55% | 0.552 | S | S | . | * | trans | -76.4 | 99.1 | 176.1 | -169.7 | 0 | 0 | 0 | 0 | 109.1 | K145 S149 | K145-S147 PolarHBondContact O-N 3.43Å; S147-S149 PolarHBondContact O-N 3.41Å | ||
| 148 | N | 53.2 | Low | 65.3 | Low | 128 Ų | 128 | 100.8 Ų | 100.8 | 68% | 0.684 | 57% | 0.568 | S | S | * | * | trans | -65 | 112.5 | 164.7 | -72 | -7 | 0 | 0 | 0 | 107.4 | V146 T150 | V146-N148 PolarHBondContact O-N 2.97Å; V146-N148 VanDerWaalsContact O-N 3.11Å; N148-T150 PolarHBondContact O-N 3.26Å | ||
| 149 | S | 47.1 | Very low | 64.2 | Low | 117 Ų | 117 | 106.3 Ų | 106.3 | 82% | 0.818 | 60% | 0.602 | S | S | * | * | S | Bend | trans | -72 | 32.8 | -171.2 | -47 | 0 | 0 | 0 | 0 | 114.8 | S147 | S147-S149 PolarHBondContact O-N 3.41Š|
| 150 | T | 41.9 | Very low | 63.6 | Low | 117 Ų | 117 | 107.9 Ų | 107.9 | 72% | 0.718 | 61% | 0.612 | S | S | * | * | trans | -126.7 | 29 | -164.5 | 52.7 | 0 | 0 | 0 | 0 | 114.3 | N148 | N148-T150 PolarHBondContact O-N 3.26Š| ||
| 151 | E | 43.5 | Very low | 63.2 | Low | 169 Ų | 169 | 111.3 Ų | 111.3 | 79% | 0.79 | 63% | 0.628 | S | S | * | * | trans | -127.8 | 74.3 | 156.3 | -73.2 | -160.3 | -178 | 0 | 0 | 111.2 | N153 | E151-N153 VanDerWaalsContact C-N 3.32Å; E151-N153 PolarHBondContact O-N 2.95Å | ||
| 152 | T | 46.2 | Very low | 62.5 | Low | 138 Ų | 138 | 110.3 Ų | 110.3 | 85% | 0.847 | 63% | 0.632 | S | S | * | * | trans | -59.8 | 96.1 | 151.1 | 25.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 153 | N | 41.8 | Very low | 62 | Low | 131 Ų | 131 | 111.7 Ų | 111.7 | 70% | 0.701 | 65% | 0.646 | S | S | * | * | trans | -127.9 | 95.5 | 157.5 | -88.1 | -44.5 | 0 | 0 | 0 | 108.9 | E151 | E151-N153 VanDerWaalsContact C-N 3.32Å; E151-N153 PolarHBondContact O-N 2.95Å | ||
| 154 | N | 51.3 | Low | 61.8 | Low | 151 Ų | 151 | 110.3 Ų | 110.3 | 81% | 0.807 | 64% | 0.644 | S | S | * | * | S | Bend | trans | 28 | 143.8 | 156 | -65.6 | -29.2 | 0 | 0 | 0 | 121.8 | ||
| 155 | S | 44 | Very low | 61.8 | Low | 115 Ų | 115 | 110.6 Ų | 110.6 | 80% | 0.804 | 65% | 0.646 | S | S | * | * | trans | 106.8 | 24.6 | 153 | 76.7 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 156 | D | 50.3 | Low | 62.3 | Low | 124 Ų | 124 | 109.2 Ų | 109.2 | 66% | 0.663 | 64% | 0.64 | S | S | * | * | trans | -143.7 | 102.7 | 167.5 | -127.8 | 1 | 0 | 0 | 0 | 112.7 | V158 K166 | D156-V158 PolarHBondContact O-N 3.43Å; D156-K166 VanDerWaalsContact CG-NZ 3.26Å; D156-K166 IonicContact OD2-NZ 3.75Å; D156-K166 PolarHBondContact OD2-NZ 3.18Å | ||
| 157 | N | 52.9 | Low | 63.2 | Low | 171 Ų | 171 | 104.3 Ų | 104.3 | 91% | 0.914 | 61% | 0.61 | S | S | * | * | trans | -73.2 | 36.3 | -167.1 | -68 | -19.6 | 0 | 0 | 0 | 115.9 | ||||
| 158 | V | 60.8 | Low | 64.8 | Low | 87 Ų | 87 | 104.8 Ų | 104.8 | 53% | 0.527 | 61% | 0.607 | S | S | . | * | trans | -119.5 | 94.5 | 177.4 | -179 | 0 | 0 | 0 | 0 | 109.2 | D156 | D156-V158 PolarHBondContact O-N 3.43Š| ||
| 159 | T | 72.4 | Confident | 66.5 | Low | 139 Ų | 139 | 101.2 Ų | 101.2 | 85% | 0.853 | 59% | 0.586 | S | S | * | * | trans | -81.4 | 111.8 | 172.8 | 39.6 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 160 | C | 80.6 | Confident | 68.4 | Low | 32 Ų | 32 | 98.4 Ų | 98.4 | 22% | 0.216 | 56% | 0.559 | C | S | . | * | P | Polyproline II helix | trans | -70.8 | 160.4 | 168.1 | -63.3 | 0 | 0 | 0 | 0 | 111 | C71 Q164 | C71-C160 HydrophobicContact CB-CB 3.77Å; C71-C160 WeakPolarHBondContact CB-SG 3.38Å; C71-C160 WeakPolarHBondContact SG-CA 3.5Å; C71-C160 WeakPolarHBondContact SG-CB 3.47Å; C71-C160 CovalentContact SG-SG 2.04Å; C71-C160 PolarHBondContact SG-SG 3.39Å; C160-Q164 HydrophobicContact CB-CB 3.97Å |
| 161 | Q | 82.3 | Confident | 70.4 | Confident | 138 Ų | 138 | 94.6 Ų | 94.6 | 65% | 0.645 | 54% | 0.54 | S | S | * | . | P | Polyproline II helix | trans | -62.5 | 155.5 | 175.3 | -71.8 | -74.8 | -19.6 | 0 | 0 | 111.5 | G163 Q164 | Q161-G163 PolarHBondContact O-N 2.93Å; Q161-Q164 HydrophobicContact CB-CG 4.42Å; Q161-Q164 WeakPolarHBondContact O-CB 3.49Å; Q161-Q164 PolarHBondContact O-N 3.01Å |
| 162 | P | 76.4 | Confident | 72.6 | Confident | 125 Ų | 125 | 86.6 Ų | 86.6 | 81% | 0.812 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53 | 127.8 | 174.1 | -25.1 | 34.8 | 0 | 0 | 0 | 111.8 | ||
| 163 | G | 77.4 | Confident | 74.7 | Confident | 75 Ų | 75 | 80 Ų | 80 | 77% | 0.773 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 88.2 | -3.1 | -175.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | Q161 | Q161-G163 PolarHBondContact O-N 2.93Š|
| 164 | Q | 83.9 | Confident | 77.1 | Confident | 77 Ų | 77 | 75.2 Ų | 75.2 | 36% | 0.36 | 44% | 0.436 | S | S | . | . | trans | -110.6 | 151.3 | 174.4 | -62.6 | -174.2 | -26 | 0 | 0 | 112 | C71 S72 C160 Q161 | C71-Q164 HydrophobicContact CB-CB 4.5Å; S72-Q164 WeakPolarHBondContact O-CA 3.29Å; C160-Q164 HydrophobicContact CB-CB 3.97Å; Q161-Q164 HydrophobicContact CB-CG 4.42Å; Q161-Q164 WeakPolarHBondContact O-CB 3.49Å; Q161-Q164 PolarHBondContact O-N 3.01Å | ||
| 165 | M | 85.3 | Confident | 79 | Confident | 36 Ų | 36 | 68.6 Ų | 68.6 | 18% | 0.177 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.7 | 159.5 | 174.3 | 64.8 | 173.2 | -76.4 | 0 | 0 | 111.5 | C71 S72 F74 C167 A171 V172 | C71-M165 WeakPolarHBondContact CA-O 3.48Å; S72-M165 PolarHBondContact N-O 3.45Å; S72-M165 PolarHBondContact O-N 2.95Å; F74-M165 HydrophobicContact CD2-SD 3.8Å; M165-C167 PolarHBondContact O-N 2.97Å; M165-A171 HydrophobicContact CE-CB 3.99Å; M165-V172 HydrophobicContact CE-CG1 3.66Å; M165-V172 HydrophobicContact SD-CG1 4Å |
| 166 | K | 87.8 | Confident | 81.4 | Confident | 52 Ų | 52 | 67.5 Ų | 67.5 | 23% | 0.226 | 38% | 0.383 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -62.2 | 120.3 | 166.7 | -71.6 | -173.7 | 177 | -176.6 | 0 | 109.3 | G69 D156 L168 | G69-K166 WeakPolarHBondContact O-CA 3.32Å; G69-K166 WeakPolarHBondContact O-CB 3.34Å; D156-K166 VanDerWaalsContact CG-NZ 3.26Å; D156-K166 IonicContact OD2-NZ 3.75Å; D156-K166 PolarHBondContact OD2-NZ 3.18Å; K166-L168 PolarHBondContact O-N 3.15Å |
| 167 | C | 90.7 | Very high | 83.5 | Confident | 0 Ų | 0 | 61.6 Ų | 61.6 | 0% | 0 | 35% | 0.352 | C | S | . | . | trans | -80.9 | 100.2 | -178 | -178.1 | 0 | 0 | 0 | 0 | 111.3 | F70 C77 M165 | F70-C167 HydrophobicContact CD1-CB 3.76Å; F70-C167 HydrophobicContact CE1-CB 3.5Å; F70-C167 VanDerWaalsContact CE1-CB 3.5Å; F70-C167 HydrophobicContact CZ-CB 4.18Å; F70-C167 VanDerWaalsContact O-CB 3.26Å; F70-C167 WeakPolarHBondContact O-CB 3.32Å; F70-C167 PolarHBondContact O-N 3.28Å; C77-C167 WeakPolarHBondContact CA-SG 3.43Å; C77-C167 HydrophobicContact CB-CB 3.74Å; C77-C167 WeakPolarHBondContact CB-SG 3.47Å; C77-C167 WeakPolarHBondContact SG-CA 3.29Å; C77-C167 WeakPolarHBondContact SG-CB 3.11Å; C77-C167 CovalentContact SG-SG 2.03Å; C77-C167 PolarHBondContact SG-SG 3.33Å; M165-C167 PolarHBondContact O-N 2.97Å | ||
| 168 | L | 90.1 | Very high | 85.5 | Confident | 79 Ų | 79 | 53.8 Ų | 53.8 | 41% | 0.414 | 31% | 0.31 | S | S | . | . | trans | -125.9 | 138.4 | 176.4 | -64.2 | 173.6 | 0 | 0 | 0 | 109.9 | K166 E170 A171 V172 | K166-L168 PolarHBondContact O-N 3.15Å; L168-E170 PolarHBondContact O-N 3.4Å; L168-A171 HydrophobicContact CB-CB 4.07Å; L168-A171 WeakPolarHBondContact O-CB 3.35Å; L168-A171 PolarHBondContact O-N 3.17Å; L168-A171 VanDerWaalsContact O-N 3.11Å; L168-V172 PolarHBondContact O-N 3.31Å | ||
| 169 | F | 89.8 | Confident | 87.1 | Confident | 53 Ų | 53 | 49.6 Ų | 49.6 | 23% | 0.232 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -54.4 | -53 | -175 | -176.4 | -93 | 0 | 0 | 0 | 112.8 | I66 A81 A171 V172 V173 M178 | I66-F169 HydrophobicContact CG2-CB 4.29Å; A81-F169 HydrophobicContact CB-CD2 3.92Å; A81-F169 HydrophobicContact CB-CE2 4.35Å; F169-A171 PolarHBondContact O-N 3.26Å; F169-V172 PolarHBondContact O-N 3.32Å; F169-V173 HydrophobicContact CD2-CG2 4.12Å; F169-V173 HydrophobicContact CE1-CB 4.32Å; F169-V173 HydrophobicContact CE1-CG2 4.45Å; F169-V173 HydrophobicContact CE2-CG2 3.91Å; F169-V173 HydrophobicContact CG-CG2 4.48Å; F169-V173 HydrophobicContact CZ-CB 4.29Å; F169-V173 HydrophobicContact CZ-CG1 4.31Å; F169-V173 HydrophobicContact CZ-CG2 4.08Å; F169-V173 PolarHBondContact O-N 3.25Å; F169-M178 HydrophobicContact CE1-CE 4.26Å; F169-M178 HydrophobicContact CE1-CG 4.22Å; F169-M178 HydrophobicContact CE1-SD 4.27Å; F169-M178 HydrophobicContact CZ-CE 3.84Å; F169-M178 HydrophobicContact CZ-CG 4.29Å; F169-M178 HydrophobicContact CZ-SD 3.75Å |
| 170 | E | 86.3 | Confident | 88.3 | Confident | 57 Ų | 57 | 48.6 Ų | 48.6 | 27% | 0.266 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -67.9 | -17.1 | -177.9 | -49.4 | -169.9 | 173.8 | 0 | 0 | 113.9 | K145 L168 M175 | K145-E170 PolarHBondContact NZ-O 2.99Å; L168-E170 PolarHBondContact O-N 3.4Å; E170-M175 HydrophobicContact CB-CE 3.92Å; E170-M175 HydrophobicContact CG-CE 3.52Å |
| 171 | A | 84.8 | Confident | 89 | Confident | 38 Ų | 38 | 50 Ų | 50 | 31% | 0.314 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -82.4 | -30.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | K145 M165 L168 F169 | K145-A171 WeakPolarHBondContact CB-O 3.49Å; M165-A171 HydrophobicContact CE-CB 3.99Å; L168-A171 HydrophobicContact CB-CB 4.07Å; L168-A171 WeakPolarHBondContact O-CB 3.35Å; L168-A171 PolarHBondContact O-N 3.17Å; L168-A171 VanDerWaalsContact O-N 3.11Å; F169-A171 PolarHBondContact O-N 3.26Å |
| 172 | V | 88.9 | Confident | 89.6 | Confident | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -103.8 | -31.9 | -178.6 | -57.5 | 0 | 0 | 0 | 0 | 113.4 | F74 C77 L78 A81 K145 M165 L168 F169 | F74-V172 HydrophobicContact CD2-CG1 4.12Å; F74-V172 HydrophobicContact CE2-CB 4.15Å; F74-V172 HydrophobicContact CE2-CG1 3.98Å; C77-V172 HydrophobicContact CB-CG1 4.33Å; L78-V172 HydrophobicContact CD1-CB 4.09Å; L78-V172 HydrophobicContact CD1-CG2 4.03Å; A81-V172 HydrophobicContact CB-CG2 4.06Å; K145-V172 PolarHBondContact N-O 2.88Å; K145-V172 VanDerWaalsContact N-O 3.09Å; M165-V172 HydrophobicContact CE-CG1 3.66Å; M165-V172 HydrophobicContact SD-CG1 4Å; L168-V172 PolarHBondContact O-N 3.31Å; F169-V172 PolarHBondContact O-N 3.32Å |
| 173 | V | 91.5 | Very high | 90.6 | Very high | 1 Ų | 1 | 38.3 Ų | 38.3 | 1% | 0.006 | 20% | 0.203 | C | C | . | . | B | Isolated β-bridge | trans | -92.8 | 137.1 | -179.9 | -168.8 | 0 | 0 | 0 | 0 | 110.9 | L78 A81 K145 F169 Y177 M178 | L78-V173 HydrophobicContact CD1-CG2 4.4Å; A81-V173 HydrophobicContact CB-CG2 4.07Å; K145-V173 WeakPolarHBondContact CE-O 3.43Å; F169-V173 HydrophobicContact CD2-CG2 4.12Å; F169-V173 HydrophobicContact CE1-CB 4.32Å; F169-V173 HydrophobicContact CE1-CG2 4.45Å; F169-V173 HydrophobicContact CE2-CG2 3.91Å; F169-V173 HydrophobicContact CG-CG2 4.48Å; F169-V173 HydrophobicContact CZ-CB 4.29Å; F169-V173 HydrophobicContact CZ-CG1 4.31Å; F169-V173 HydrophobicContact CZ-CG2 4.08Å; F169-V173 PolarHBondContact O-N 3.25Å; V173-Y177 HydrophobicContact CG1-CD1 3.9Å; V173-Y177 HydrophobicContact CG1-CE1 4.35Å; V173-M178 HydrophobicContact CG1-CG 3.68Å; V173-M178 HydrophobicContact CG1-SD 3.86Å |
| 174 | N | 91.7 | Very high | 91.4 | Very high | 29 Ų | 29 | 38.1 Ų | 38.1 | 16% | 0.155 | 18% | 0.181 | C | C | . | . | trans | -78.2 | 132.8 | 173.6 | -171.8 | -1.1 | 0 | 0 | 0 | 111 | K145 E176 Y177 M178 | K145-N174 HydrophobicContact CG-CB 4.42Å; N174-E176 VanDerWaalsContact C-N 3.31Å; N174-E176 PolarHBondContact ND2-OE2 3.48Å; N174-E176 PolarHBondContact O-N 2.99Å; N174-E176 PolarHBondContact OD1-N 3.38Å; N174-E176 VanDerWaalsContact OD1-N 3.08Å; N174-Y177 WeakPolarHBondContact O-CB 3.27Å; N174-Y177 PolarHBondContact O-N 3.49Å; N174-M178 PolarHBondContact O-N 2.88Å; N174-M178 VanDerWaalsContact O-N 3.09Å | ||
| 175 | M | 91.3 | Very high | 92 | Very high | 13 Ų | 13 | 36.5 Ų | 36.5 | 6% | 0.064 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -67.5 | -30.7 | 176.6 | -72.5 | -62 | -179.2 | 0 | 0 | 112.5 | E170 Y177 M178 V179 T257 L258 | E170-M175 HydrophobicContact CB-CE 3.92Å; E170-M175 HydrophobicContact CG-CE 3.52Å; M175-Y177 VanDerWaalsContact C-N 3.33Å; M175-Y177 PolarHBondContact O-N 2.99Å; M175-M178 PolarHBondContact O-N 3.39Å; M175-M178 VanDerWaalsContact O-N 3.17Å; M175-V179 WeakPolarHBondContact O-CG2 3.36Å; M175-V179 PolarHBondContact O-N 3.47Å; M175-T257 HydrophobicContact CE-CG2 4.02Å; M175-L258 HydrophobicContact CB-CB 4.33Å; M175-L258 HydrophobicContact CB-CD1 3.99Å |
| 176 | E | 93.4 | Very high | 92.5 | Very high | 92 Ų | 92 | 35.2 Ų | 35.2 | 43% | 0.43 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -61.4 | -42.7 | 173.2 | -60.8 | 174.1 | 138 | 0 | 0 | 111.6 | N174 V179 Y180 L258 | N174-E176 VanDerWaalsContact C-N 3.31Å; N174-E176 PolarHBondContact ND2-OE2 3.48Å; N174-E176 PolarHBondContact O-N 2.99Å; N174-E176 PolarHBondContact OD1-N 3.38Å; N174-E176 VanDerWaalsContact OD1-N 3.08Å; E176-V179 PolarHBondContact O-N 2.92Å; E176-Y180 HydrophobicContact CB-CD2 4.03Å; E176-Y180 HydrophobicContact CB-CE2 4.33Å; E176-Y180 HydrophobicContact CG-CE2 4.42Å; E176-Y180 WeakPolarHBondContact O-CB 3.31Å; E176-Y180 WeakPolarHBondContact O-CD2 3.31Å; E176-Y180 PolarHBondContact O-N 3.28Å; E176-L258 HydrophobicContact CG-CD1 4.05Å |
| 177 | Y | 94.6 | Very high | 92.7 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 16% | 0.164 | C | C | . | . | I | π-helix | trans | -62.6 | -44.4 | 172.9 | 163.3 | -90.2 | 0 | 0 | 0 | 110.7 | L85 I135 T138 P139 W143 V173 N174 M175 V179 F181 N182 | L85-Y177 HydrophobicContact CD1-CE1 3.8Å; I135-Y177 PolarHBondContact O-OH 2.91Å; T138-Y177 HydrophobicContact CG2-CD2 4.18Å; T138-Y177 HydrophobicContact CG2-CE2 3.85Å; P139-Y177 HydrophobicContact CG-CD1 3.76Å; P139-Y177 HydrophobicContact CG-CD2 4.16Å; P139-Y177 HydrophobicContact CG-CE1 3.49Å; P139-Y177 VanDerWaalsContact CG-CE1 3.49Å; P139-Y177 HydrophobicContact CG-CE2 3.9Å; P139-Y177 HydrophobicContact CG-CG 4.11Å; W143-Y177 HydrophobicContact CD2-CD2 4.23Å; W143-Y177 HydrophobicContact CE3-CD2 4.05Å; V173-Y177 HydrophobicContact CG1-CD1 3.9Å; V173-Y177 HydrophobicContact CG1-CE1 4.35Å; N174-Y177 WeakPolarHBondContact O-CB 3.27Å; N174-Y177 PolarHBondContact O-N 3.49Å; M175-Y177 VanDerWaalsContact C-N 3.33Å; M175-Y177 PolarHBondContact O-N 2.99Å; Y177-V179 VanDerWaalsContact C-N 3.34Å; Y177-V179 PolarHBondContact O-N 2.99Å; Y177-F181 HydrophobicContact CD2-CB 4.21Å; Y177-F181 AromaticContact CD2-CD1 3.83Å; Y177-F181 HydrophobicContact CD2-CD1 3.83Å; Y177-F181 HydrophobicContact CD2-CG 4.38Å; Y177-F181 AromaticContact CE2-CD1 3.42Å; Y177-F181 HydrophobicContact CE2-CD1 3.42Å; Y177-F181 VanDerWaalsContact CE2-CD1 3.42Å; Y177-F181 AromaticContact CE2-CE1 3.98Å; Y177-F181 HydrophobicContact CE2-CE1 3.98Å; Y177-F181 HydrophobicContact CE2-CG 4.38Å; Y177-F181 PolarHBondContact O-N 2.85Å; Y177-N182 HydrophobicContact CE1-CB 4.29Å; Y177-N182 WeakPolarHBondContact O-CB 3.25Å; Y177-N182 PolarHBondContact O-N 3.36Å |
| 178 | M | 94.9 | Very high | 92.9 | Very high | 6 Ų | 6 | 35.2 Ų | 35.2 | 3% | 0.03 | 18% | 0.177 | C | C | . | . | I | π-helix | trans | -64.8 | -33.7 | 179.7 | -72.3 | -57.2 | -60.5 | 0 | 0 | 113.8 | L85 F169 V173 N174 M175 N182 F183 | L85-M178 HydrophobicContact CD1-SD 3.94Å; L85-M178 HydrophobicContact CD2-CE 3.95Å; L85-M178 HydrophobicContact CD2-SD 4.21Å; F169-M178 HydrophobicContact CE1-CE 4.26Å; F169-M178 HydrophobicContact CE1-CG 4.22Å; F169-M178 HydrophobicContact CE1-SD 4.27Å; F169-M178 HydrophobicContact CZ-CE 3.84Å; F169-M178 HydrophobicContact CZ-CG 4.29Å; F169-M178 HydrophobicContact CZ-SD 3.75Å; V173-M178 HydrophobicContact CG1-CG 3.68Å; V173-M178 HydrophobicContact CG1-SD 3.86Å; N174-M178 PolarHBondContact O-N 2.88Å; N174-M178 VanDerWaalsContact O-N 3.09Å; M175-M178 PolarHBondContact O-N 3.39Å; M175-M178 VanDerWaalsContact O-N 3.17Å; M178-N182 HydrophobicContact SD-CB 4.47Å; M178-F183 WeakPolarHBondContact O-CB 3.41Å; M178-F183 PolarHBondContact O-N 3.09Å |
| 179 | V | 96 | Very high | 93.1 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 18% | 0.184 | C | C | . | . | I | π-helix | trans | -93 | -56.6 | -177 | 175.2 | 0 | 0 | 0 | 0 | 112.2 | M175 E176 Y177 F183 F184 N254 L258 F259 | M175-V179 WeakPolarHBondContact O-CG2 3.36Å; M175-V179 PolarHBondContact O-N 3.47Å; E176-V179 PolarHBondContact O-N 2.92Å; Y177-V179 VanDerWaalsContact C-N 3.34Å; Y177-V179 PolarHBondContact O-N 2.99Å; V179-F183 WeakPolarHBondContact O-CB 3.39Å; V179-F184 HydrophobicContact CG1-CD2 4.48Å; V179-F184 HydrophobicContact CG1-CE1 4.41Å; V179-F184 HydrophobicContact CG1-CE2 3.94Å; V179-F184 HydrophobicContact CG1-CZ 3.9Å; V179-F184 WeakPolarHBondContact O-CG 3.35Å; V179-F184 PolarHBondContact O-N 3Å; V179-N254 HydrophobicContact CG2-CB 4.04Å; V179-N254 WeakPolarHBondContact CG2-O 3.45Å; V179-L258 HydrophobicContact CB-CD2 3.59Å; V179-L258 HydrophobicContact CG1-CD2 3.93Å; V179-L258 HydrophobicContact CG2-CB 4.04Å; V179-L258 HydrophobicContact CG2-CD2 3.76Å; V179-F259 HydrophobicContact CG1-CE2 3.7Å; V179-F259 HydrophobicContact CG1-CZ 3.66Å |
| 180 | Y | 96.1 | Very high | 93.3 | Very high | 118 Ų | 118 | 34.5 Ų | 34.5 | 46% | 0.463 | 18% | 0.176 | S | C | . | . | I | π-helix | trans | -75.2 | -46.6 | -173.5 | -62 | -61.1 | 0 | 0 | 0 | 112.3 | E176 F184 A185 L258 F259 | E176-Y180 HydrophobicContact CB-CD2 4.03Å; E176-Y180 HydrophobicContact CB-CE2 4.33Å; E176-Y180 HydrophobicContact CG-CE2 4.42Å; E176-Y180 WeakPolarHBondContact O-CB 3.31Å; E176-Y180 WeakPolarHBondContact O-CD2 3.31Å; E176-Y180 PolarHBondContact O-N 3.28Å; Y180-F184 AromaticContact CD1-CD2 3.97Å; Y180-F184 HydrophobicContact CD1-CD2 3.97Å; Y180-F184 AromaticContact CD1-CE2 3.99Å; Y180-F184 HydrophobicContact CD1-CE2 3.99Å; Y180-F184 HydrophobicContact CE1-CE2 4.32Å; Y180-A185 PolarHBondContact O-N 2.95Å; Y180-L258 HydrophobicContact CD2-CD2 4.43Å; Y180-L258 HydrophobicContact CE2-CD2 3.98Å; Y180-F259 HydrophobicContact CE1-CE1 4.07Å; Y180-F259 HydrophobicContact CE1-CZ 4.01Å; Y180-F259 AromaticContact CZ-CE1 3.96Å |
| 181 | F | 95.9 | Very high | 93.5 | Very high | 62 Ų | 62 | 32.5 Ų | 32.5 | 27% | 0.272 | 17% | 0.167 | S | C | . | . | I | π-helix | trans | -87 | -59.4 | -175.9 | -173 | -103.6 | 0 | 0 | 0 | 111.7 | I135 T138 W143 Y177 A185 C186 | I135-F181 HydrophobicContact CB-CE1 4.42Å; I135-F181 HydrophobicContact CG1-CE1 4.39Å; I135-F181 HydrophobicContact CG1-CZ 4.31Å; I135-F181 HydrophobicContact CG2-CE1 3.93Å; T138-F181 HydrophobicContact CG2-CE1 4.45Å; W143-F181 HydrophobicContact CH2-CB 4.2Å; W143-F181 HydrophobicContact CZ3-CB 4.19Å; W143-F181 HydrophobicContact CZ3-CD2 4.44Å; W143-F181 HydrophobicContact CZ3-CG 4.28Å; Y177-F181 HydrophobicContact CD2-CB 4.21Å; Y177-F181 AromaticContact CD2-CD1 3.83Å; Y177-F181 HydrophobicContact CD2-CD1 3.83Å; Y177-F181 HydrophobicContact CD2-CG 4.38Å; Y177-F181 AromaticContact CE2-CD1 3.42Å; Y177-F181 HydrophobicContact CE2-CD1 3.42Å; Y177-F181 VanDerWaalsContact CE2-CD1 3.42Å; Y177-F181 AromaticContact CE2-CE1 3.98Å; Y177-F181 HydrophobicContact CE2-CE1 3.98Å; Y177-F181 HydrophobicContact CE2-CG 4.38Å; Y177-F181 PolarHBondContact O-N 2.85Å; F181-A185 WeakPolarHBondContact O-CB 3.36Å; F181-A185 PolarHBondContact O-N 3.49Å; F181-C186 PolarHBondContact O-N 2.92Å; F181-C186 PolarHBondContact O-SG 3.36Å |
| 182 | N | 95.6 | Very high | 93.8 | Very high | 2 Ų | 2 | 35.2 Ų | 35.2 | 1% | 0.011 | 18% | 0.175 | C | C | . | . | I | π-helix | trans | -66.7 | -55.9 | -176.4 | -175.3 | -92.3 | 0 | 0 | 0 | 111.5 | Y177 M178 C186 V187 H251 | Y177-N182 HydrophobicContact CE1-CB 4.29Å; Y177-N182 WeakPolarHBondContact O-CB 3.25Å; Y177-N182 PolarHBondContact O-N 3.36Å; M178-N182 HydrophobicContact SD-CB 4.47Å; N182-C186 CarbonylContact O-C 3.46Å; N182-C186 WeakPolarHBondContact O-CA 3.3Å; N182-C186 WeakPolarHBondContact O-CB 3.37Å; N182-C186 PolarHBondContact O-N 2.94Å; N182-V187 VanDerWaalsContact O-CG2 3.28Å; N182-V187 WeakPolarHBondContact O-CG2 3.41Å; N182-V187 PolarHBondContact O-N 3.48Å; N182-H251 PolarHBondContact OD1-CE1 3.4Å |
| 183 | F | 95.8 | Very high | 94 | Very high | 14 Ų | 14 | 39.1 Ų | 39.1 | 6% | 0.061 | 20% | 0.196 | C | C | . | . | I | π-helix | trans | -71.8 | -65.6 | -179.3 | 179.3 | -140.9 | 0 | 0 | 0 | 113.3 | M178 V179 V187 L188 L248 H251 | M178-F183 WeakPolarHBondContact O-CB 3.41Å; M178-F183 PolarHBondContact O-N 3.09Å; V179-F183 WeakPolarHBondContact O-CB 3.39Å; F183-V187 HydrophobicContact CD2-CB 4.21Å; F183-V187 HydrophobicContact CD2-CG1 4.37Å; F183-V187 WeakPolarHBondContact O-CB 3.27Å; F183-V187 PolarHBondContact O-N 2.93Å; F183-V187 VanDerWaalsContact O-N 3.15Å; F183-L188 HydrophobicContact CD2-CB 4.48Å; F183-L188 HydrophobicContact CE2-CB 4.25Å; F183-L188 WeakPolarHBondContact O-CB 3.4Å; F183-L188 PolarHBondContact O-N 3.13Å; F183-L248 HydrophobicContact CE2-CD2 3.79Å; F183-L248 HydrophobicContact CZ-CD2 3.99Å; F183-H251 HydrophobicContact CB-CB 4.22Å; F183-H251 WeakPolarHBondContact CB-ND1 3.43Å; F183-H251 HydrophobicContact CD1-CB 3.84Å; F183-H251 HydrophobicContact CD2-CB 3.39Å; F183-H251 AromaticContact CD2-CD2 3.71Å; F183-H251 AromaticContact CD2-CG 3.33Å; F183-H251 AromaticContact CD2-ND1 3.7Å; F183-H251 HydrophobicContact CE1-CB 3.97Å; F183-H251 HydrophobicContact CE2-CB 3.56Å; F183-H251 AromaticContact CE2-CG 3.88Å; F183-H251 HydrophobicContact CG-CB 3.55Å; F183-H251 AromaticContact CG-CG 3.68Å; F183-H251 AromaticContact CG-ND1 3.73Å; F183-H251 HydrophobicContact CZ-CB 3.85Å |
| 184 | F | 96.2 | Very high | 94 | Very high | 72 Ų | 72 | 39.2 Ų | 39.2 | 32% | 0.316 | 20% | 0.196 | S | C | . | . | I | π-helix | trans | -66 | -51.1 | -171.9 | -63.2 | -23.2 | 0 | 0 | 0 | 112.6 | V179 Y180 L188 I189 F259 | V179-F184 HydrophobicContact CG1-CD2 4.48Å; V179-F184 HydrophobicContact CG1-CE1 4.41Å; V179-F184 HydrophobicContact CG1-CE2 3.94Å; V179-F184 HydrophobicContact CG1-CZ 3.9Å; V179-F184 WeakPolarHBondContact O-CG 3.35Å; V179-F184 PolarHBondContact O-N 3Å; Y180-F184 AromaticContact CD1-CD2 3.97Å; Y180-F184 HydrophobicContact CD1-CD2 3.97Å; Y180-F184 AromaticContact CD1-CE2 3.99Å; Y180-F184 HydrophobicContact CD1-CE2 3.99Å; Y180-F184 HydrophobicContact CE1-CE2 4.32Å; F184-L188 HydrophobicContact CD1-CD2 4.06Å; F184-I189 PolarHBondContact O-N 2.95Å; F184-F259 HydrophobicContact CE2-CZ 4.16Å; F184-F259 HydrophobicContact CZ-CE2 4.1Å; F184-F259 HydrophobicContact CZ-CZ 4.18Å |
| 185 | A | 95.8 | Very high | 93.8 | Very high | 42 Ų | 42 | 41.7 Ų | 41.7 | 35% | 0.347 | 21% | 0.209 | S | C | . | . | I | π-helix | trans | -77.2 | -44.1 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y180 F181 | Y180-A185 PolarHBondContact O-N 2.95Å; F181-A185 WeakPolarHBondContact O-CB 3.36Å; F181-A185 PolarHBondContact O-N 3.49Å |
| 186 | C | 95.3 | Very high | 93.8 | Very high | 10 Ų | 10 | 43.4 Ų | 43.4 | 7% | 0.068 | 23% | 0.225 | C | C | . | . | I | π-helix | trans | -98.3 | -17.4 | -168.1 | -55.4 | 0 | 0 | 0 | 0 | 115.5 | Q89 I135 F181 N182 P190 | Q89-C186 PolarHBondContact NE2-O 2.95Å; Q89-C186 VanDerWaalsContact OE1-CB 3.27Å; Q89-C186 PolarHBondContact OE1-O 3.15Å; I135-C186 HydrophobicContact CG2-CB 4.13Å; F181-C186 PolarHBondContact O-N 2.92Å; F181-C186 PolarHBondContact O-SG 3.36Å; N182-C186 CarbonylContact O-C 3.46Å; N182-C186 WeakPolarHBondContact O-CA 3.3Å; N182-C186 WeakPolarHBondContact O-CB 3.37Å; N182-C186 PolarHBondContact O-N 2.94Å; C186-P190 WeakPolarHBondContact O-CG 3.43Å |
| 187 | V | 92.8 | Very high | 93.6 | Very high | 1 Ų | 1 | 40 Ų | 40 | 1% | 0.006 | 21% | 0.21 | C | C | . | . | I | π-helix | trans | -112 | -52.7 | 176.7 | 179 | 0 | 0 | 0 | 0 | 111.9 | I92 N182 F183 P190 L191 F243 | I92-V187 HydrophobicContact CD1-CB 4.12Å; I92-V187 HydrophobicContact CD1-CG1 4.17Å; I92-V187 HydrophobicContact CD1-CG2 3.53Å; N182-V187 VanDerWaalsContact O-CG2 3.28Å; N182-V187 WeakPolarHBondContact O-CG2 3.41Å; N182-V187 PolarHBondContact O-N 3.48Å; F183-V187 HydrophobicContact CD2-CB 4.21Å; F183-V187 HydrophobicContact CD2-CG1 4.37Å; F183-V187 WeakPolarHBondContact O-CB 3.27Å; F183-V187 PolarHBondContact O-N 2.93Å; F183-V187 VanDerWaalsContact O-N 3.15Å; V187-P190 WeakPolarHBondContact O-CD 3.17Å; V187-L191 VanDerWaalsContact O-CB 3.27Å; V187-L191 WeakPolarHBondContact O-CB 3.26Å; V187-L191 PolarHBondContact O-N 2.84Å; V187-F243 HydrophobicContact CG1-CE1 4.45Å |
| 188 | L | 94.1 | Very high | 93.1 | Very high | 51 Ų | 51 | 40.8 Ų | 40.8 | 27% | 0.267 | 21% | 0.213 | S | C | . | . | I | π-helix | trans | -69.5 | -43.8 | -172.5 | -177.1 | 62.7 | 0 | 0 | 0 | 112.3 | F183 F184 L191 L192 | F183-L188 HydrophobicContact CD2-CB 4.48Å; F183-L188 HydrophobicContact CE2-CB 4.25Å; F183-L188 WeakPolarHBondContact O-CB 3.4Å; F183-L188 PolarHBondContact O-N 3.13Å; F184-L188 HydrophobicContact CD1-CD2 4.06Å; L188-L191 PolarHBondContact O-N 3.28Å; L188-L192 HydrophobicContact CD1-CD1 4.26Å; L188-L192 HydrophobicContact CD1-CG 4.18Å; L188-L192 HydrophobicContact CG-CD1 4.05Å; L188-L192 HydrophobicContact CG-CG 4.4Å; L188-L192 WeakPolarHBondContact O-CB 3.31Å; L188-L192 VanDerWaalsContact O-CG 3.3Å; L188-L192 WeakPolarHBondContact O-CG 3.46Å; L188-L192 PolarHBondContact O-N 2.94Å |
| 189 | I | 94.9 | Very high | 92.6 | Very high | 107 Ų | 107 | 44.8 Ų | 44.8 | 55% | 0.549 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -60.3 | -51.1 | 175.9 | -69.4 | 173.3 | 0 | 0 | 0 | 111.5 | F184 L191 L192 L193 | F184-I189 PolarHBondContact O-N 2.95Å; I189-L191 VanDerWaalsContact C-N 3.31Å; I189-L191 PolarHBondContact O-N 3.47Å; I189-L192 PolarHBondContact O-N 3Å; I189-L193 WeakPolarHBondContact O-CB 3.29Å; I189-L193 PolarHBondContact O-N 3.13Å |
| 190 | P | 92.7 | Very high | 92.1 | Very high | 10 Ų | 10 | 47 Ų | 47 | 7% | 0.065 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58.4 | -37.3 | 172.7 | -31.4 | 40.1 | 0 | 0 | 0 | 114.3 | I92 L96 C186 V187 L193 M194 | I92-P190 HydrophobicContact CG2-CB 3.49Å; I92-P190 VanDerWaalsContact CG2-CB 3.49Å; I92-P190 HydrophobicContact CG2-CG 3.96Å; L96-P190 HydrophobicContact CD2-CB 4.32Å; C186-P190 WeakPolarHBondContact O-CG 3.43Å; V187-P190 WeakPolarHBondContact O-CD 3.17Å; P190-L193 PolarHBondContact O-N 3.33Å; P190-M194 WeakPolarHBondContact O-CB 3.49Å; P190-M194 WeakPolarHBondContact O-CG 3.38Å; P190-M194 PolarHBondContact O-N 3.1Å |
| 191 | L | 90.8 | Very high | 91.4 | Very high | 15 Ų | 15 | 41.5 Ų | 41.5 | 8% | 0.079 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -64.6 | -45.2 | 177.4 | -175.7 | 61.5 | 0 | 0 | 0 | 112.1 | V187 L188 I189 M194 L195 V240 F243 A244 L248 | V187-L191 VanDerWaalsContact O-CB 3.27Å; V187-L191 WeakPolarHBondContact O-CB 3.26Å; V187-L191 PolarHBondContact O-N 2.84Å; L188-L191 PolarHBondContact O-N 3.28Å; I189-L191 VanDerWaalsContact C-N 3.31Å; I189-L191 PolarHBondContact O-N 3.47Å; L191-M194 HydrophobicContact CD1-CE 4.18Å; L191-M194 PolarHBondContact O-N 2.87Å; L191-L195 WeakPolarHBondContact O-CB 3.39Å; L191-L195 PolarHBondContact O-N 3.43Å; L191-V240 HydrophobicContact CD1-CG1 3.86Å; L191-F243 HydrophobicContact CD1-CD1 4Å; L191-A244 HydrophobicContact CD1-CB 4.3Å; L191-A244 HydrophobicContact CD2-CB 4.1Å; L191-L248 HydrophobicContact CD2-CD2 4.19Å; L191-L248 HydrophobicContact CD2-CG 4.47Å |
| 192 | L | 92.6 | Very high | 90.6 | Very high | 95 Ų | 95 | 43 Ų | 43 | 50% | 0.497 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64.9 | -38.8 | 175.1 | -69.3 | 173.2 | 0 | 0 | 0 | 111.7 | L188 I189 L195 A196 | L188-L192 HydrophobicContact CD1-CD1 4.26Å; L188-L192 HydrophobicContact CD1-CG 4.18Å; L188-L192 HydrophobicContact CG-CD1 4.05Å; L188-L192 HydrophobicContact CG-CG 4.4Å; L188-L192 WeakPolarHBondContact O-CB 3.31Å; L188-L192 VanDerWaalsContact O-CG 3.3Å; L188-L192 WeakPolarHBondContact O-CG 3.46Å; L188-L192 PolarHBondContact O-N 2.94Å; I189-L192 PolarHBondContact O-N 3Å; L192-L195 PolarHBondContact O-N 3.39Å; L192-A196 WeakPolarHBondContact O-CB 3.08Å; L192-A196 PolarHBondContact O-N 3.21Å |
| 193 | L | 93 | Very high | 90 | Very high | 81 Ų | 81 | 48.4 Ų | 48.4 | 42% | 0.424 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -65.5 | -44.4 | 175.5 | -178.8 | 58.6 | 0 | 0 | 0 | 111.7 | L96 I189 P190 A196 I197 | L96-L193 HydrophobicContact CD1-CB 4.35Å; L96-L193 HydrophobicContact CD1-CD2 3.77Å; L96-L193 HydrophobicContact CD1-CG 3.86Å; L96-L193 HydrophobicContact CD2-CD2 4.07Å; I189-L193 WeakPolarHBondContact O-CB 3.29Å; I189-L193 PolarHBondContact O-N 3.13Å; P190-L193 PolarHBondContact O-N 3.33Å; L193-A196 PolarHBondContact O-N 3.36Å; L193-I197 HydrophobicContact CD1-CD1 4.06Å; L193-I197 HydrophobicContact CD1-CG1 4.34Å; L193-I197 HydrophobicContact CG-CD1 3.96Å; L193-I197 WeakPolarHBondContact O-CB 3.21Å; L193-I197 WeakPolarHBondContact O-CD1 3.46Å; L193-I197 VanDerWaalsContact O-CG1 3.23Å; L193-I197 WeakPolarHBondContact O-CG1 3.26Å; L193-I197 PolarHBondContact O-N 3.41Å |
| 194 | M | 90.3 | Very high | 89.2 | Confident | 3 Ų | 3 | 48.4 Ų | 48.4 | 2% | 0.015 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -58.9 | -47.1 | 172.3 | -75.4 | -170.8 | -71.3 | 0 | 0 | 111.3 | L95 L96 A99 P190 L191 A196 I197 Y198 V240 | L95-M194 HydrophobicContact CB-SD 3.77Å; L96-M194 HydrophobicContact CB-CG 4.15Å; L96-M194 HydrophobicContact CB-SD 4.33Å; L96-M194 HydrophobicContact CD1-CG 3.76Å; A99-M194 HydrophobicContact CB-CG 4.08Å; P190-M194 WeakPolarHBondContact O-CB 3.49Å; P190-M194 WeakPolarHBondContact O-CG 3.38Å; P190-M194 PolarHBondContact O-N 3.1Å; L191-M194 HydrophobicContact CD1-CE 4.18Å; L191-M194 PolarHBondContact O-N 2.87Å; M194-A196 PolarHBondContact O-N 2.91Å; M194-I197 PolarHBondContact O-N 3.47Å; M194-Y198 HydrophobicContact CB-CD2 4.49Å; M194-Y198 HydrophobicContact CB-CE2 4.38Å; M194-Y198 WeakPolarHBondContact O-CD2 3.37Å; M194-Y198 PolarHBondContact O-N 3Å; M194-V240 HydrophobicContact CB-CG2 4.19Å |
| 195 | L | 88.8 | Confident | 88.2 | Confident | 82 Ų | 82 | 45.1 Ų | 45.1 | 43% | 0.429 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -58.2 | -49.7 | 177.1 | 178.3 | 62.1 | 0 | 0 | 0 | 111.4 | L191 L192 I197 Y198 L199 | L191-L195 WeakPolarHBondContact O-CB 3.39Å; L191-L195 PolarHBondContact O-N 3.43Å; L192-L195 PolarHBondContact O-N 3.39Å; L195-I197 VanDerWaalsContact C-N 3.34Å; L195-I197 PolarHBondContact O-N 3.5Å; L195-Y198 PolarHBondContact O-N 3.38Å; L195-L199 HydrophobicContact CD1-CD1 4.12Å; L195-L199 HydrophobicContact CD1-CG 4.16Å; L195-L199 HydrophobicContact CG-CD1 3.98Å; L195-L199 HydrophobicContact CG-CG 4.43Å; L195-L199 WeakPolarHBondContact O-CB 3.5Å; L195-L199 VanDerWaalsContact O-CG 3.29Å; L195-L199 WeakPolarHBondContact O-CG 3.47Å; L195-L199 PolarHBondContact O-N 3.48Å |
| 196 | A | 90.6 | Very high | 87.2 | Confident | 49 Ų | 49 | 49.1 Ų | 49.1 | 41% | 0.405 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -59.5 | -43.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L192 L193 M194 Y198 L199 C200 | L192-A196 WeakPolarHBondContact O-CB 3.08Å; L192-A196 PolarHBondContact O-N 3.21Å; L193-A196 PolarHBondContact O-N 3.36Å; M194-A196 PolarHBondContact O-N 2.91Å; A196-Y198 PolarHBondContact O-N 2.99Å; A196-L199 PolarHBondContact O-N 3.2Å; A196-C200 WeakPolarHBondContact O-CB 3.46Å; A196-C200 PolarHBondContact O-N 3.26Å; A196-C200 PolarHBondContact O-SG 3.42Å |
| 197 | I | 89.1 | Confident | 86.3 | Confident | 19 Ų | 19 | 54.2 Ų | 54.2 | 10% | 0.097 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -58.8 | -48.1 | 175.2 | -75.5 | 166.9 | 0 | 0 | 0 | 111.2 | L96 A99 I100 Y103 L193 M194 L195 C200 I201 | L96-I197 HydrophobicContact CD1-CD1 4.18Å; A99-I197 HydrophobicContact CB-CG2 4.15Å; A99-I197 WeakPolarHBondContact O-CG2 3.38Å; I100-I197 HydrophobicContact CG1-CD1 3.73Å; Y103-I197 HydrophobicContact CD2-CG2 4.06Å; Y103-I197 HydrophobicContact CG-CG2 4.24Å; L193-I197 HydrophobicContact CD1-CD1 4.06Å; L193-I197 HydrophobicContact CD1-CG1 4.34Å; L193-I197 HydrophobicContact CG-CD1 3.96Å; L193-I197 WeakPolarHBondContact O-CB 3.21Å; L193-I197 WeakPolarHBondContact O-CD1 3.46Å; L193-I197 VanDerWaalsContact O-CG1 3.23Å; L193-I197 WeakPolarHBondContact O-CG1 3.26Å; L193-I197 PolarHBondContact O-N 3.41Å; M194-I197 PolarHBondContact O-N 3.47Å; L195-I197 VanDerWaalsContact C-N 3.34Å; L195-I197 PolarHBondContact O-N 3.5Å; I197-C200 WeakPolarHBondContact O-CB 3.05Å; I197-C200 PolarHBondContact O-N 3.27Å; I197-I201 HydrophobicContact CG2-CD1 3.91Å; I197-I201 WeakPolarHBondContact O-CG1 3.39Å; I197-I201 PolarHBondContact O-N 2.9Å |
| 198 | Y | 83 | Confident | 85.4 | Confident | 18 Ų | 18 | 57.9 Ų | 57.9 | 7% | 0.071 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -72.6 | -32.1 | -179 | -70.1 | -58 | 0 | 0 | 0 | 113.6 | A99 M194 L195 A196 I201 F202 L236 V240 | A99-Y198 WeakPolarHBondContact CA-OH 3.36Å; A99-Y198 HydrophobicContact CB-CE1 4.25Å; A99-Y198 HydrophobicContact CB-CE2 3.63Å; A99-Y198 WeakPolarHBondContact CB-OH 3.41Å; M194-Y198 HydrophobicContact CB-CD2 4.49Å; M194-Y198 HydrophobicContact CB-CE2 4.38Å; M194-Y198 WeakPolarHBondContact O-CD2 3.37Å; M194-Y198 PolarHBondContact O-N 3Å; L195-Y198 PolarHBondContact O-N 3.38Å; A196-Y198 PolarHBondContact O-N 2.99Å; Y198-I201 HydrophobicContact CD1-CD1 3.75Å; Y198-I201 HydrophobicContact CE1-CD1 4.11Å; Y198-I201 PolarHBondContact O-N 3.37Å; Y198-F202 WeakPolarHBondContact O-CB 3.29Å; Y198-F202 PolarHBondContact O-N 3.24Å; Y198-L236 HydrophobicContact CD1-CB 3.65Å; Y198-L236 HydrophobicContact CD1-CD1 4.31Å; Y198-L236 HydrophobicContact CD1-CG 4.5Å; Y198-L236 HydrophobicContact CE1-CB 3.44Å; Y198-L236 VanDerWaalsContact CE1-CB 3.44Å; Y198-L236 HydrophobicContact CE1-CD1 3.89Å; Y198-L236 HydrophobicContact CE1-CD2 4.05Å; Y198-L236 HydrophobicContact CE1-CG 3.98Å; Y198-L236 HydrophobicContact CG-CB 4.44Å; Y198-V240 HydrophobicContact CD2-CG2 3.39Å; Y198-V240 HydrophobicContact CE2-CG2 3.29Å |
| 199 | L | 84.7 | Confident | 84.3 | Confident | 89 Ų | 89 | 57 Ų | 57 | 47% | 0.466 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -62.2 | -44.9 | 168.3 | -70.7 | 173.4 | 0 | 0 | 0 | 110.6 | L195 A196 I201 F202 M203 | L195-L199 HydrophobicContact CD1-CD1 4.12Å; L195-L199 HydrophobicContact CD1-CG 4.16Å; L195-L199 HydrophobicContact CG-CD1 3.98Å; L195-L199 HydrophobicContact CG-CG 4.43Å; L195-L199 WeakPolarHBondContact O-CB 3.5Å; L195-L199 VanDerWaalsContact O-CG 3.29Å; L195-L199 WeakPolarHBondContact O-CG 3.47Å; L195-L199 PolarHBondContact O-N 3.48Å; A196-L199 PolarHBondContact O-N 3.2Å; L199-I201 VanDerWaalsContact C-N 3.35Å; L199-I201 PolarHBondContact O-N 3Å; L199-F202 PolarHBondContact O-N 3.26Å; L199-M203 WeakPolarHBondContact O-CB 3.28Å; L199-M203 VanDerWaalsContact O-CG 3.28Å; L199-M203 WeakPolarHBondContact O-CG 3.34Å; L199-M203 PolarHBondContact O-N 3.29Å |
| 200 | C | 86.1 | Confident | 83.3 | Confident | 47 Ų | 47 | 58.6 Ų | 58.6 | 32% | 0.318 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -61.4 | -38.2 | 174.7 | -75.2 | 0 | 0 | 0 | 0 | 113.3 | Y103 A196 I197 A204 | Y103-C200 HydrophobicContact CE2-CB 3.97Å; A196-C200 WeakPolarHBondContact O-CB 3.46Å; A196-C200 PolarHBondContact O-N 3.26Å; A196-C200 PolarHBondContact O-SG 3.42Å; I197-C200 WeakPolarHBondContact O-CB 3.05Å; I197-C200 PolarHBondContact O-N 3.27Å; C200-A204 VanDerWaalsContact O-CB 3.27Å; C200-A204 WeakPolarHBondContact O-CB 3.39Å; C200-A204 PolarHBondContact O-N 2.69Å |
| 201 | I | 82.1 | Confident | 82.5 | Confident | 2 Ų | 2 | 62.3 Ų | 62.3 | 1% | 0.01 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -64.6 | -48.6 | 172.7 | -71 | 163 | 0 | 0 | 0 | 110.5 | Y103 I106 I197 Y198 L199 A204 A205 A233 | Y103-I201 HydrophobicContact CD2-CD1 4.46Å; Y103-I201 HydrophobicContact CD2-CG1 4.01Å; I106-I201 HydrophobicContact CD1-CG1 4.48Å; I106-I201 HydrophobicContact CD1-CG2 3.61Å; I197-I201 HydrophobicContact CG2-CD1 3.91Å; I197-I201 WeakPolarHBondContact O-CG1 3.39Å; I197-I201 PolarHBondContact O-N 2.9Å; Y198-I201 HydrophobicContact CD1-CD1 3.75Å; Y198-I201 HydrophobicContact CE1-CD1 4.11Å; Y198-I201 PolarHBondContact O-N 3.37Å; L199-I201 VanDerWaalsContact C-N 3.35Å; L199-I201 PolarHBondContact O-N 3Å; I201-A204 WeakPolarHBondContact O-CB 3.36Å; I201-A204 PolarHBondContact O-N 3.32Å; I201-A205 PolarHBondContact O-N 3.49Å; I201-A233 HydrophobicContact CG2-CB 4.29Å |
| 202 | F | 79 | Confident | 81.5 | Confident | 94 Ų | 94 | 63 Ų | 63 | 41% | 0.412 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63.8 | -44.8 | -178.7 | -177.9 | -101.9 | 0 | 0 | 0 | 112 | Y198 L199 A204 A205 R206 | Y198-F202 WeakPolarHBondContact O-CB 3.29Å; Y198-F202 PolarHBondContact O-N 3.24Å; L199-F202 PolarHBondContact O-N 3.26Å; F202-A204 VanDerWaalsContact C-N 3.33Å; F202-A204 PolarHBondContact O-N 3.49Å; F202-A205 PolarHBondContact O-N 2.93Å; F202-R206 HydrophobicContact CD1-CG 4.16Å; F202-R206 HydrophobicContact CE1-CG 3.81Å; F202-R206 HydrophobicContact CE2-CG 4.21Å; F202-R206 HydrophobicContact CZ-CG 3.84Å; F202-R206 WeakPolarHBondContact O-CB 3.39Å; F202-R206 WeakPolarHBondContact O-CG 3.38Å; F202-R206 PolarHBondContact O-N 2.94Å |
| 203 | M | 81.9 | Confident | 80.5 | Confident | 116 Ų | 116 | 64 Ų | 64 | 57% | 0.571 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -60.6 | -41.4 | 174.2 | -71.1 | -171.3 | -63.8 | 0 | 0 | 111.7 | L199 R206 H207 | L199-M203 WeakPolarHBondContact O-CB 3.28Å; L199-M203 VanDerWaalsContact O-CG 3.28Å; L199-M203 WeakPolarHBondContact O-CG 3.34Å; L199-M203 PolarHBondContact O-N 3.29Å; M203-R206 PolarHBondContact O-N 3.24Å; M203-H207 WeakPolarHBondContact O-CB 3.34Å; M203-H207 PolarHBondContact O-N 3.37Å |
| 204 | A | 80.5 | Confident | 79.3 | Confident | 13 Ų | 13 | 65.3 Ų | 65.3 | 11% | 0.107 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -62.5 | -48.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | K107 C200 I201 F202 R206 H207 Q208 | K107-A204 HydrophobicContact CD-CB 4.16Å; C200-A204 VanDerWaalsContact O-CB 3.27Å; C200-A204 WeakPolarHBondContact O-CB 3.39Å; C200-A204 PolarHBondContact O-N 2.69Å; I201-A204 WeakPolarHBondContact O-CB 3.36Å; I201-A204 PolarHBondContact O-N 3.32Å; F202-A204 VanDerWaalsContact C-N 3.33Å; F202-A204 PolarHBondContact O-N 3.49Å; A204-R206 VanDerWaalsContact C-N 3.32Å; A204-R206 PolarHBondContact O-N 3.5Å; A204-H207 WeakPolarHBondContact O-CB 3.41Å; A204-H207 PolarHBondContact O-N 2.94Å; A204-Q208 PolarHBondContact O-N 2.91Å |
| 205 | A | 73.6 | Confident | 78.2 | Confident | 4 Ų | 4 | 71 Ų | 71 | 3% | 0.033 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -63.4 | -38 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | I201 F202 L209 L226 V230 | I201-A205 PolarHBondContact O-N 3.49Å; F202-A205 PolarHBondContact O-N 2.93Å; A205-L209 WeakPolarHBondContact O-CB 3.26Å; A205-L209 PolarHBondContact O-N 3.41Å; A205-L226 HydrophobicContact CB-CD1 4.47Å; A205-V230 HydrophobicContact CB-CG2 4.06Å |
| 206 | R | 75.4 | Confident | 76.9 | Confident | 125 Ų | 125 | 68.9 Ų | 68.9 | 47% | 0.472 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -67.5 | -35.2 | 174.1 | -70.4 | -73.3 | -73.6 | 166.8 | -3.4 | 112.5 | F202 M203 A204 L209 K210 | F202-R206 HydrophobicContact CD1-CG 4.16Å; F202-R206 HydrophobicContact CE1-CG 3.81Å; F202-R206 HydrophobicContact CE2-CG 4.21Å; F202-R206 HydrophobicContact CZ-CG 3.84Å; F202-R206 WeakPolarHBondContact O-CB 3.39Å; F202-R206 WeakPolarHBondContact O-CG 3.38Å; F202-R206 PolarHBondContact O-N 2.94Å; M203-R206 PolarHBondContact O-N 3.24Å; A204-R206 VanDerWaalsContact C-N 3.32Å; A204-R206 PolarHBondContact O-N 3.5Å; R206-L209 PolarHBondContact O-N 3.5Å; R206-K210 PolarHBondContact O-N 2.91Å |
| 207 | H | 77.3 | Confident | 75.4 | Confident | 118 Ų | 118 | 75.9 Ų | 75.9 | 55% | 0.546 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -67.2 | -48.7 | 175 | -173.1 | -90.3 | 0 | 0 | 0 | 111.4 | M203 A204 L209 K210 L211 | M203-H207 WeakPolarHBondContact O-CB 3.34Å; M203-H207 PolarHBondContact O-N 3.37Å; A204-H207 WeakPolarHBondContact O-CB 3.41Å; A204-H207 PolarHBondContact O-N 2.94Å; H207-L209 PolarHBondContact O-N 3.3Å; H207-K210 PolarHBondContact O-N 3.43Å; H207-L211 PolarHBondContact O-N 3.43Å; H207-L211 VanDerWaalsContact O-N 3.15Å |
| 208 | Q | 72.6 | Confident | 74 | Confident | 78 Ų | 78 | 85.8 Ų | 85.8 | 36% | 0.364 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -57.2 | -34.8 | 173.4 | -72.6 | 168.7 | -29 | 0 | 0 | 111.8 | A204 L211 I212 L226 | A204-Q208 PolarHBondContact O-N 2.91Å; Q208-L211 PolarHBondContact O-N 2.86Å; Q208-I212 WeakPolarHBondContact O-CG1 3.41Å; Q208-I212 PolarHBondContact O-N 2.87Å; Q208-L226 HydrophobicContact CB-CD1 4.35Å; Q208-L226 HydrophobicContact CB-CD2 3.92Å |
| 209 | L | 70.7 | Confident | 72.6 | Confident | 32 Ų | 32 | 88 Ų | 88 | 17% | 0.168 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -68.6 | -36.7 | -179.9 | -170.4 | 67.5 | 0 | 0 | 0 | 112.2 | A205 R206 H207 E213 L226 | A205-L209 WeakPolarHBondContact O-CB 3.26Å; A205-L209 PolarHBondContact O-N 3.41Å; R206-L209 PolarHBondContact O-N 3.5Å; H207-L209 PolarHBondContact O-N 3.3Å; L209-E213 WeakPolarHBondContact O-CB 3.39Å; L209-E213 PolarHBondContact O-N 3.38Å; L209-L226 HydrophobicContact CB-CD2 3.73Å; L209-L226 HydrophobicContact CB-CG 4.43Å; L209-L226 HydrophobicContact CD1-CD2 3.75Å; L209-L226 HydrophobicContact CD1-CG 4.06Å; L209-L226 HydrophobicContact CG-CD2 4.36Å; L209-L226 VanDerWaalsContact N-CD2 3.35Å |
| 210 | K | 74.8 | Confident | 71.4 | Confident | 140 Ų | 140 | 91.4 Ų | 91.4 | 61% | 0.609 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -67.2 | -40.7 | 173.4 | -70.6 | -175 | 175.3 | -170.8 | 0 | 112.1 | R206 H207 E213 V214 | R206-K210 PolarHBondContact O-N 2.91Å; H207-K210 PolarHBondContact O-N 3.43Å; K210-E213 PolarHBondContact O-N 3.05Å; K210-V214 WeakPolarHBondContact O-CG2 3.49Å; K210-V214 PolarHBondContact O-N 3.24Å; K210-V214 VanDerWaalsContact O-N 3.13Å |
| 211 | L | 74.9 | Confident | 70 | Confident | 88 Ų | 88 | 98.7 Ų | 98.7 | 46% | 0.461 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.4 | -48.1 | 176.2 | -65.5 | 176.4 | 0 | 0 | 0 | 111.1 | H207 Q208 E213 V214 E215 | H207-L211 PolarHBondContact O-N 3.43Å; H207-L211 VanDerWaalsContact O-N 3.15Å; Q208-L211 PolarHBondContact O-N 2.86Å; L211-E213 VanDerWaalsContact C-N 3.26Å; L211-E213 PolarHBondContact O-N 2.83Å; L211-V214 PolarHBondContact O-N 2.88Å; L211-V214 VanDerWaalsContact O-N 3.16Å; L211-E215 PolarHBondContact O-N 3.33Å |
| 212 | I | 71.1 | Confident | 68.9 | Low | 30 Ų | 30 | 100.8 Ų | 100.8 | 15% | 0.154 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -65.9 | -27.6 | 176.9 | -65.8 | -179.3 | 0 | 0 | 0 | 111.9 | Q208 E215 A216 L226 | Q208-I212 WeakPolarHBondContact O-CG1 3.41Å; Q208-I212 PolarHBondContact O-N 2.87Å; I212-E215 PolarHBondContact O-N 3.46Å; I212-A216 WeakPolarHBondContact O-CA 3.23Å; I212-A216 WeakPolarHBondContact O-CB 3.36Å; I212-A216 PolarHBondContact O-N 2.98Å; I212-L226 HydrophobicContact CD1-CB 4.47Å; I212-L226 HydrophobicContact CD1-CD2 3.76Å |
| 213 | E | 70.8 | Confident | 68.1 | Low | 115 Ų | 115 | 102.6 Ų | 102.6 | 54% | 0.537 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -69.1 | -37.7 | 173.6 | -175.1 | 162 | -145.5 | 0 | 0 | 112.3 | L209 K210 L211 | L209-E213 WeakPolarHBondContact O-CB 3.39Å; L209-E213 PolarHBondContact O-N 3.38Å; K210-E213 PolarHBondContact O-N 3.05Å; L211-E213 VanDerWaalsContact C-N 3.26Å; L211-E213 PolarHBondContact O-N 2.83Å |
| 214 | V | 67.7 | Low | 67.2 | Low | 110 Ų | 110 | 100 Ų | 100 | 67% | 0.667 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -68.4 | -40.4 | 171.7 | 174.9 | 0 | 0 | 0 | 0 | 111.3 | K210 L211 | K210-V214 WeakPolarHBondContact O-CG2 3.49Å; K210-V214 PolarHBondContact O-N 3.24Å; K210-V214 VanDerWaalsContact O-N 3.13Å; L211-V214 PolarHBondContact O-N 2.88Å; L211-V214 VanDerWaalsContact O-N 3.16Å |
| 215 | E | 67.9 | Low | 66.4 | Low | 121 Ų | 121 | 102.7 Ų | 102.7 | 57% | 0.565 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -77 | -24 | 178.5 | -68.5 | 175.8 | 155.6 | 0 | 0 | 113.3 | L211 I212 F217 R218 | L211-E215 PolarHBondContact O-N 3.33Å; I212-E215 PolarHBondContact O-N 3.46Å; E215-F217 PolarHBondContact O-N 2.96Å; E215-R218 WeakPolarHBondContact O-CA 3.44Å; E215-R218 VanDerWaalsContact O-CB 3.29Å; E215-R218 WeakPolarHBondContact O-CB 3.36Å; E215-R218 PolarHBondContact O-N 2.89Å |
| 216 | A | 61.5 | Low | 65.9 | Low | 38 Ų | 38 | 102.7 Ų | 102.7 | 31% | 0.314 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66 | -21.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | I212 R218 G219 | I212-A216 WeakPolarHBondContact O-CA 3.23Å; I212-A216 WeakPolarHBondContact O-CB 3.36Å; I212-A216 PolarHBondContact O-N 2.98Å; A216-R218 PolarHBondContact O-N 3.46Å; A216-R218 VanDerWaalsContact O-N 3.15Å; A216-G219 PolarHBondContact O-N 2.99Å |
| 217 | F | 58.9 | Low | 65.4 | Low | 196 Ų | 196 | 101.4 Ų | 101.4 | 86% | 0.86 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -14.2 | 166 | -91 | -88 | 0 | 0 | 0 | 113.2 | E215 | E215-F217 PolarHBondContact O-N 2.96Š|
| 218 | R | 60 | Low | 64.7 | Low | 228 Ų | 228 | 102.2 Ų | 102.2 | 86% | 0.86 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.2 | 3.1 | 172.6 | -57.9 | -178.4 | 170.2 | -173.2 | -3.9 | 114.2 | E215 A216 | E215-R218 WeakPolarHBondContact O-CA 3.44Å; E215-R218 VanDerWaalsContact O-CB 3.29Å; E215-R218 WeakPolarHBondContact O-CB 3.36Å; E215-R218 PolarHBondContact O-N 2.89Å; A216-R218 PolarHBondContact O-N 3.46Å; A216-R218 VanDerWaalsContact O-N 3.15Å |
| 219 | G | 53.5 | Low | 64.3 | Low | 65 Ų | 65 | 103 Ų | 103 | 67% | 0.67 | 51% | 0.508 | S | S | * | . | trans | 98.2 | 6 | 162.7 | 0 | 0 | 0 | 0 | 0 | 118.7 | A216 | A216-G219 PolarHBondContact O-N 2.99Š| ||
| 220 | E | 60.1 | Low | 64.1 | Low | 159 Ų | 159 | 103.1 Ų | 103.1 | 74% | 0.743 | 51% | 0.51 | S | S | * | . | trans | -85.3 | 142.3 | -177.5 | -70.9 | -158.6 | 140.2 | 0 | 0 | 115.7 | S222 | E220-S222 PolarHBondContact O-N 3.38Š| ||
| 221 | K | 55.3 | Low | 63.7 | Low | 200 Ų | 200 | 102.5 Ų | 102.5 | 87% | 0.87 | 51% | 0.509 | S | S | * | . | trans | -76.9 | 24.2 | -173.1 | -73.3 | 179.2 | 175.5 | 171.3 | 0 | 115.7 | R223 | K221-R223 PolarHBondContact O-N 2.86Š| ||
| 222 | S | 59.7 | Low | 63.1 | Low | 47 Ų | 47 | 100.6 Ų | 100.6 | 33% | 0.329 | 51% | 0.506 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75 | -13.8 | -169.6 | -156.1 | 0 | 0 | 0 | 0 | 115.5 | E220 S224 T225 | E220-S222 PolarHBondContact O-N 3.38Å; S222-S224 PolarHBondContact O-N 2.91Å; S222-S224 VanDerWaalsContact O-N 3.08Å; S222-T225 PolarHBondContact O-N 3.4Å; S222-T225 PolarHBondContact O-OG1 3.27Å |
| 223 | R | 61.5 | Low | 62.7 | Low | 131 Ų | 131 | 99.6 Ų | 99.6 | 49% | 0.494 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -54.5 | -31.6 | 179.9 | -97.6 | 173.6 | 66.4 | 110.5 | -10.8 | 114.8 | K221 Q227 | K221-R223 PolarHBondContact O-N 2.86Å; R223-Q227 WeakPolarHBondContact O-CB 3.29Å; R223-Q227 VanDerWaalsContact O-CG 3.29Å; R223-Q227 WeakPolarHBondContact O-CG 3.41Å; R223-Q227 PolarHBondContact O-N 2.89Å; R223-Q227 VanDerWaalsContact O-N 3.17Å |
| 224 | S | 64.1 | Low | 62.7 | Low | 62 Ų | 62 | 100.9 Ų | 100.9 | 43% | 0.434 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -78.5 | -24.4 | -170.2 | 82.7 | 0 | 0 | 0 | 0 | 115 | S222 K228 | S222-S224 PolarHBondContact O-N 2.91Å; S222-S224 VanDerWaalsContact O-N 3.08Å; S224-K228 VanDerWaalsContact O-CD 3.26Å; S224-K228 WeakPolarHBondContact O-CD 3.34Å; S224-K228 WeakPolarHBondContact O-CE 3.24Å; S224-K228 WeakPolarHBondContact O-CG 3.48Å |
| 225 | T | 63.2 | Low | 62.5 | Low | 70 Ų | 70 | 96.3 Ų | 96.3 | 43% | 0.429 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -76.6 | -51.3 | 174.7 | 17.4 | 0 | 0 | 0 | 0 | 109.7 | S222 Q227 K228 E229 | S222-T225 PolarHBondContact O-N 3.4Å; S222-T225 PolarHBondContact O-OG1 3.27Å; T225-Q227 VanDerWaalsContact C-N 3.34Å; T225-Q227 PolarHBondContact O-N 3.07Å; T225-K228 WeakPolarHBondContact O-CA 3.47Å; T225-K228 VanDerWaalsContact O-CB 3.32Å; T225-K228 WeakPolarHBondContact O-CB 3.22Å; T225-K228 PolarHBondContact O-N 2.88Å; T225-E229 PolarHBondContact O-N 3.36Å |
| 226 | L | 63 | Low | 62.4 | Low | 4 Ų | 4 | 91.6 Ų | 91.6 | 2% | 0.021 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -67.1 | -31 | -177.7 | -173.7 | 55.5 | 0 | 0 | 0 | 113.6 | A205 Q208 L209 I212 K228 E229 V230 | A205-L226 HydrophobicContact CB-CD1 4.47Å; Q208-L226 HydrophobicContact CB-CD1 4.35Å; Q208-L226 HydrophobicContact CB-CD2 3.92Å; L209-L226 HydrophobicContact CB-CD2 3.73Å; L209-L226 HydrophobicContact CB-CG 4.43Å; L209-L226 HydrophobicContact CD1-CD2 3.75Å; L209-L226 HydrophobicContact CD1-CG 4.06Å; L209-L226 HydrophobicContact CG-CD2 4.36Å; L209-L226 VanDerWaalsContact N-CD2 3.35Å; I212-L226 HydrophobicContact CD1-CB 4.47Å; I212-L226 HydrophobicContact CD1-CD2 3.76Å; L226-K228 VanDerWaalsContact C-N 3.28Å; L226-K228 PolarHBondContact O-N 2.71Å; L226-E229 HydrophobicContact CD1-CB 4.18Å; L226-E229 WeakPolarHBondContact CD1-OE2 3.48Å; L226-E229 PolarHBondContact O-N 3.43Å; L226-V230 WeakPolarHBondContact O-CG2 3.32Å; L226-V230 PolarHBondContact O-N 3.27Å |
| 227 | Q | 64.5 | Low | 62.8 | Low | 98 Ų | 98 | 92.6 Ų | 92.6 | 46% | 0.458 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -60.9 | -35.9 | 169.7 | -79.7 | 179 | -21.9 | 0 | 0 | 112.7 | R223 T225 Q231 | R223-Q227 WeakPolarHBondContact O-CB 3.29Å; R223-Q227 VanDerWaalsContact O-CG 3.29Å; R223-Q227 WeakPolarHBondContact O-CG 3.41Å; R223-Q227 PolarHBondContact O-N 2.89Å; R223-Q227 VanDerWaalsContact O-N 3.17Å; T225-Q227 VanDerWaalsContact C-N 3.34Å; T225-Q227 PolarHBondContact O-N 3.07Å; Q227-Q231 WeakPolarHBondContact O-CB 3.38Å; Q227-Q231 PolarHBondContact O-N 3.44Å |
| 228 | K | 63.7 | Low | 63.6 | Low | 134 Ų | 134 | 86.8 Ų | 86.8 | 58% | 0.583 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -68.8 | -36 | 175.1 | -63.2 | 159.7 | -170.9 | 156.1 | 0 | 111 | S224 T225 L226 Q231 A232 | S224-K228 VanDerWaalsContact O-CD 3.26Å; S224-K228 WeakPolarHBondContact O-CD 3.34Å; S224-K228 WeakPolarHBondContact O-CE 3.24Å; S224-K228 WeakPolarHBondContact O-CG 3.48Å; T225-K228 WeakPolarHBondContact O-CA 3.47Å; T225-K228 VanDerWaalsContact O-CB 3.32Å; T225-K228 WeakPolarHBondContact O-CB 3.22Å; T225-K228 PolarHBondContact O-N 2.88Å; L226-K228 VanDerWaalsContact C-N 3.28Å; L226-K228 PolarHBondContact O-N 2.71Å; K228-Q231 PolarHBondContact O-N 3.21Å; K228-A232 WeakPolarHBondContact O-CB 3.31Å; K228-A232 PolarHBondContact O-N 2.9Å |
| 229 | E | 63.3 | Low | 64.2 | Low | 96 Ų | 96 | 77.2 Ų | 77.2 | 45% | 0.449 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -69.9 | -43.3 | 177.2 | -69.1 | 168.9 | -165.4 | 0 | 0 | 112.5 | T225 L226 Q231 A232 A233 | T225-E229 PolarHBondContact O-N 3.36Å; L226-E229 HydrophobicContact CD1-CB 4.18Å; L226-E229 WeakPolarHBondContact CD1-OE2 3.48Å; L226-E229 PolarHBondContact O-N 3.43Å; E229-Q231 VanDerWaalsContact C-N 3.28Å; E229-Q231 PolarHBondContact O-N 3.02Å; E229-A232 WeakPolarHBondContact O-CA 3.26Å; E229-A232 WeakPolarHBondContact O-CB 3.31Å; E229-A232 PolarHBondContact O-N 3.34Å; E229-A232 VanDerWaalsContact O-N 3.11Å; E229-A233 PolarHBondContact O-N 2.98Å |
| 230 | V | 66 | Low | 65.2 | Low | 34 Ų | 34 | 74.7 Ų | 74.7 | 21% | 0.206 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -61.5 | -39 | 171.6 | 173.9 | 0 | 0 | 0 | 0 | 110.9 | A205 L226 A233 K234 | A205-V230 HydrophobicContact CB-CG2 4.06Å; L226-V230 WeakPolarHBondContact O-CG2 3.32Å; L226-V230 PolarHBondContact O-N 3.27Å; V230-A233 PolarHBondContact O-N 3.01Å; V230-K234 PolarHBondContact O-N 3.49Å |
| 231 | Q | 66.3 | Low | 66.3 | Low | 127 Ų | 127 | 68.8 Ų | 68.8 | 59% | 0.593 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -69.3 | -33 | 174.5 | -171.5 | 158 | -6 | 0 | 0 | 112.4 | Q227 K228 E229 K234 S235 R292 | Q227-Q231 WeakPolarHBondContact O-CB 3.38Å; Q227-Q231 PolarHBondContact O-N 3.44Å; K228-Q231 PolarHBondContact O-N 3.21Å; E229-Q231 VanDerWaalsContact C-N 3.28Å; E229-Q231 PolarHBondContact O-N 3.02Å; Q231-K234 PolarHBondContact O-N 3.48Å; Q231-S235 PolarHBondContact O-N 3.44Å; Q231-S235 PolarHBondContact O-OG 3.42Å; Q231-R292 PolarHBondContact O-NH2 3.32Å |
| 232 | A | 62.6 | Low | 67.7 | Low | 47 Ų | 47 | 62 Ų | 62 | 39% | 0.388 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -62.6 | -48.5 | 170.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | K228 E229 K234 S235 L236 | K228-A232 WeakPolarHBondContact O-CB 3.31Å; K228-A232 PolarHBondContact O-N 2.9Å; E229-A232 WeakPolarHBondContact O-CA 3.26Å; E229-A232 WeakPolarHBondContact O-CB 3.31Å; E229-A232 PolarHBondContact O-N 3.34Å; E229-A232 VanDerWaalsContact O-N 3.11Å; A232-K234 VanDerWaalsContact C-N 3.34Å; A232-K234 PolarHBondContact O-N 3.48Å; A232-S235 WeakPolarHBondContact O-CA 3.47Å; A232-S235 WeakPolarHBondContact O-CB 3.44Å; A232-S235 PolarHBondContact O-N 2.69Å; A232-S235 PolarHBondContact O-OG 2.7Å; A232-L236 PolarHBondContact O-N 3.2Å |
| 233 | A | 63.7 | Low | 68.8 | Low | 10 Ų | 10 | 59.9 Ų | 59.9 | 8% | 0.083 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -57.4 | -41.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113 | I201 E229 V230 S235 L236 A237 | I201-A233 HydrophobicContact CG2-CB 4.29Å; E229-A233 PolarHBondContact O-N 2.98Å; V230-A233 PolarHBondContact O-N 3.01Å; A233-S235 PolarHBondContact O-N 3.23Å; A233-L236 PolarHBondContact O-N 2.91Å; A233-A237 PolarHBondContact O-N 2.88Å; A233-A237 VanDerWaalsContact O-N 3.09Å |
| 234 | K | 69.4 | Low | 70 | Confident | 141 Ų | 141 | 54.5 Ų | 54.5 | 61% | 0.613 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -61.2 | -28.3 | 173 | -173.6 | 170.2 | -179.2 | 174.6 | 0 | 112.9 | V230 Q231 A232 L236 I238 | V230-K234 PolarHBondContact O-N 3.49Å; Q231-K234 PolarHBondContact O-N 3.48Å; A232-K234 VanDerWaalsContact C-N 3.34Å; A232-K234 PolarHBondContact O-N 3.48Å; K234-L236 VanDerWaalsContact C-N 3.34Å; K234-I238 VanDerWaalsContact O-CD1 3.31Å; K234-I238 WeakPolarHBondContact O-CD1 3.31Å; K234-I238 VanDerWaalsContact O-CG1 3.29Å; K234-I238 WeakPolarHBondContact O-CG1 3.31Å |
| 235 | S | 64.6 | Low | 71.3 | Confident | 15 Ų | 15 | 55.8 Ų | 55.8 | 11% | 0.105 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65.6 | -40.2 | 171.9 | -32.1 | 0 | 0 | 0 | 0 | 111.9 | Q231 A232 A233 I238 I239 R292 | Q231-S235 PolarHBondContact O-N 3.44Å; Q231-S235 PolarHBondContact O-OG 3.42Å; A232-S235 WeakPolarHBondContact O-CA 3.47Å; A232-S235 WeakPolarHBondContact O-CB 3.44Å; A232-S235 PolarHBondContact O-N 2.69Å; A232-S235 PolarHBondContact O-OG 2.7Å; A233-S235 PolarHBondContact O-N 3.23Å; S235-I238 WeakPolarHBondContact O-CB 3.49Å; S235-I238 PolarHBondContact O-N 3.08Å; S235-I239 PolarHBondContact O-N 3.48Å; S235-R292 VanDerWaalsContact OG-CZ 3.28Å; S235-R292 PolarHBondContact OG-NE 3.17Å; S235-R292 PolarHBondContact OG-NH2 3.47Å |
| 236 | L | 65.3 | Low | 72.7 | Confident | 21 Ų | 21 | 52.6 Ų | 52.6 | 11% | 0.11 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -77.3 | -36.7 | -170.4 | -63.4 | 165.5 | 0 | 0 | 0 | 111.2 | R102 Y198 A232 A233 K234 I238 I239 V240 | R102-L236 HydrophobicContact CB-CD1 4.5Å; R102-L236 HydrophobicContact CG-CD1 4.48Å; R102-L236 HydrophobicContact CG-CD2 4.45Å; Y198-L236 HydrophobicContact CD1-CB 3.65Å; Y198-L236 HydrophobicContact CD1-CD1 4.31Å; Y198-L236 HydrophobicContact CD1-CG 4.5Å; Y198-L236 HydrophobicContact CE1-CB 3.44Å; Y198-L236 VanDerWaalsContact CE1-CB 3.44Å; Y198-L236 HydrophobicContact CE1-CD1 3.89Å; Y198-L236 HydrophobicContact CE1-CD2 4.05Å; Y198-L236 HydrophobicContact CE1-CG 3.98Å; Y198-L236 HydrophobicContact CG-CB 4.44Å; A232-L236 PolarHBondContact O-N 3.2Å; A233-L236 PolarHBondContact O-N 2.91Å; K234-L236 VanDerWaalsContact C-N 3.34Å; L236-I238 VanDerWaalsContact C-N 3.28Å; L236-I238 PolarHBondContact O-N 2.96Å; L236-I239 HydrophobicContact CD2-CD1 4.15Å; L236-I239 PolarHBondContact O-N 3.23Å; L236-V240 PolarHBondContact O-N 2.97Å |
| 237 | A | 69.3 | Low | 74.1 | Confident | 60 Ų | 60 | 53.3 Ų | 53.3 | 50% | 0.496 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -61.2 | -35.8 | 169.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | A233 G241 | A233-A237 PolarHBondContact O-N 2.88Å; A233-A237 VanDerWaalsContact O-N 3.09Å; A237-G241 PolarHBondContact O-N 3.15Å |
| 238 | I | 76.5 | Confident | 75.4 | Confident | 73 Ų | 73 | 51 Ų | 51 | 37% | 0.374 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -65.9 | -40 | 175 | -68.9 | 165.5 | 0 | 0 | 0 | 111 | K234 S235 L236 V240 G241 L242 | K234-I238 VanDerWaalsContact O-CD1 3.31Å; K234-I238 WeakPolarHBondContact O-CD1 3.31Å; K234-I238 VanDerWaalsContact O-CG1 3.29Å; K234-I238 WeakPolarHBondContact O-CG1 3.31Å; S235-I238 WeakPolarHBondContact O-CB 3.49Å; S235-I238 PolarHBondContact O-N 3.08Å; L236-I238 VanDerWaalsContact C-N 3.28Å; L236-I238 PolarHBondContact O-N 2.96Å; I238-V240 PolarHBondContact O-N 3.42Å; I238-G241 PolarHBondContact O-N 2.89Å; I238-L242 HydrophobicContact CG2-CD1 3.57Å; I238-L242 HydrophobicContact CG2-CG 4.21Å; I238-L242 WeakPolarHBondContact O-CB 3.49Å; I238-L242 VanDerWaalsContact O-CG 3.26Å; I238-L242 WeakPolarHBondContact O-CG 3.47Å; I238-L242 PolarHBondContact O-N 3.35Å |
| 239 | I | 72.8 | Confident | 77 | Confident | 27 Ų | 27 | 46.7 Ų | 46.7 | 14% | 0.138 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -59.6 | -47.3 | 176.8 | -70.8 | 158.5 | 0 | 0 | 0 | 111.2 | L95 S235 L236 L242 F243 I288 | L95-I239 HydrophobicContact CD2-CG2 3.99Å; S235-I239 PolarHBondContact O-N 3.48Å; L236-I239 HydrophobicContact CD2-CD1 4.15Å; L236-I239 PolarHBondContact O-N 3.23Å; I239-L242 PolarHBondContact O-N 2.93Å; I239-F243 PolarHBondContact O-N 3.43Å; I239-I288 HydrophobicContact CD1-CG2 3.91Å; I239-I288 HydrophobicContact CG1-CD1 3.79Å; I239-I288 HydrophobicContact CG1-CG2 3.73Å |
| 240 | V | 74.7 | Confident | 78.4 | Confident | 13 Ų | 13 | 43.4 Ų | 43.4 | 8% | 0.079 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -68.2 | -40.5 | 178.8 | 176 | 0 | 0 | 0 | 0 | 112.2 | L191 M194 Y198 L236 I238 L242 F243 A244 | L191-V240 HydrophobicContact CD1-CG1 3.86Å; M194-V240 HydrophobicContact CB-CG2 4.19Å; Y198-V240 HydrophobicContact CD2-CG2 3.39Å; Y198-V240 HydrophobicContact CE2-CG2 3.29Å; L236-V240 PolarHBondContact O-N 2.97Å; I238-V240 PolarHBondContact O-N 3.42Å; V240-L242 VanDerWaalsContact C-N 3.34Å; V240-L242 PolarHBondContact O-N 3.41Å; V240-F243 PolarHBondContact O-N 2.94Å; V240-A244 WeakPolarHBondContact O-CB 3.26Å; V240-A244 PolarHBondContact O-N 3.43Å |
| 241 | G | 82.1 | Confident | 79.8 | Confident | 35 Ų | 35 | 41.9 Ų | 41.9 | 36% | 0.361 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -60 | -43.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | A237 I238 A244 V245 | A237-G241 PolarHBondContact O-N 3.15Å; I238-G241 PolarHBondContact O-N 2.89Å; G241-A244 PolarHBondContact O-N 3.26Å; G241-V245 WeakPolarHBondContact O-CB 3.07Å; G241-V245 VanDerWaalsContact O-CG2 3.27Å; G241-V245 WeakPolarHBondContact O-CG2 2.99Å; G241-V245 PolarHBondContact O-N 3.08Å |
| 242 | L | 85.9 | Confident | 81.2 | Confident | 56 Ų | 56 | 39.7 Ų | 39.7 | 29% | 0.293 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -66.2 | -44.1 | 177.3 | -71.9 | 167.5 | 0 | 0 | 0 | 111.9 | I238 I239 V240 A244 V245 C246 I284 I288 | I238-L242 HydrophobicContact CG2-CD1 3.57Å; I238-L242 HydrophobicContact CG2-CG 4.21Å; I238-L242 WeakPolarHBondContact O-CB 3.49Å; I238-L242 VanDerWaalsContact O-CG 3.26Å; I238-L242 WeakPolarHBondContact O-CG 3.47Å; I238-L242 PolarHBondContact O-N 3.35Å; I239-L242 PolarHBondContact O-N 2.93Å; V240-L242 VanDerWaalsContact C-N 3.34Å; V240-L242 PolarHBondContact O-N 3.41Å; L242-A244 VanDerWaalsContact C-N 3.35Å; L242-A244 PolarHBondContact O-N 3.25Å; L242-V245 PolarHBondContact O-N 3.3Å; L242-C246 WeakPolarHBondContact O-CB 3.44Å; L242-C246 PolarHBondContact O-N 2.84Å; L242-C246 PolarHBondContact O-SG 3.06Å; L242-I284 HydrophobicContact CD1-CG2 3.96Å; L242-I288 HydrophobicContact CD1-CD1 3.72Å; L242-I288 HydrophobicContact CD1-CG1 4.31Å |
| 243 | F | 81.8 | Confident | 82.7 | Confident | 3 Ų | 3 | 38.4 Ų | 38.4 | 1% | 0.013 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -58.2 | -46.8 | 174.6 | -177.3 | -86.9 | 0 | 0 | 0 | 111.7 | I92 L95 V187 L191 I239 V240 V245 C246 W247 | I92-F243 HydrophobicContact CD1-CZ 4.03Å; I92-F243 HydrophobicContact CG1-CE1 4.16Å; I92-F243 HydrophobicContact CG1-CE2 4.01Å; I92-F243 HydrophobicContact CG1-CZ 3.37Å; L95-F243 HydrophobicContact CD1-CB 4.46Å; L95-F243 HydrophobicContact CD1-CD2 3.39Å; L95-F243 HydrophobicContact CD1-CE2 3.9Å; L95-F243 HydrophobicContact CD1-CG 4.04Å; V187-F243 HydrophobicContact CG1-CE1 4.45Å; L191-F243 HydrophobicContact CD1-CD1 4Å; I239-F243 PolarHBondContact O-N 3.43Å; V240-F243 PolarHBondContact O-N 2.94Å; F243-V245 PolarHBondContact O-N 2.94Å; F243-C246 PolarHBondContact O-N 2.03Å; F243-W247 AromaticContact CD2-CD1 3.65Å; F243-W247 AromaticContact CD2-NE1 3.96Å; F243-W247 HydrophobicContact CE1-CB 4.25Å; F243-W247 AromaticContact CE1-CD1 3.86Å; F243-W247 HydrophobicContact CE1-CG 4.14Å; F243-W247 AromaticContact CE2-CD1 3.27Å; F243-W247 HydrophobicContact CE2-CG 4.13Å; F243-W247 AromaticContact CE2-NE1 3.41Å; F243-W247 HydrophobicContact CZ-CB 4.35Å; F243-W247 AromaticContact CZ-CD1 3.36Å; F243-W247 HydrophobicContact CZ-CD2 4.43Å; F243-W247 AromaticContact CZ-CG 3.78Å; F243-W247 HydrophobicContact CZ-CG 3.78Å; F243-W247 AromaticContact CZ-NE1 3.81Å; F243-W247 PolarHBondContact O-N 3.49Å |
| 244 | A | 87.7 | Confident | 84.2 | Confident | 18 Ų | 18 | 38.1 Ų | 38.1 | 15% | 0.149 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -60.8 | -45.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | L191 V240 G241 L242 C246 W247 L248 | L191-A244 HydrophobicContact CD1-CB 4.3Å; L191-A244 HydrophobicContact CD2-CB 4.1Å; V240-A244 WeakPolarHBondContact O-CB 3.26Å; V240-A244 PolarHBondContact O-N 3.43Å; G241-A244 PolarHBondContact O-N 3.26Å; L242-A244 VanDerWaalsContact C-N 3.35Å; L242-A244 PolarHBondContact O-N 3.25Å; A244-C246 VanDerWaalsContact C-N 3.29Å; A244-C246 PolarHBondContact O-N 3.42Å; A244-W247 PolarHBondContact O-N 2.93Å; A244-L248 HydrophobicContact CB-CD1 3.95Å; A244-L248 HydrophobicContact CB-CG 4.4Å; A244-L248 WeakPolarHBondContact O-CB 3.45Å; A244-L248 WeakPolarHBondContact O-CG 3.27Å; A244-L248 PolarHBondContact O-N 3.44Å |
| 245 | V | 92.1 | Very high | 85.4 | Confident | 90 Ų | 90 | 32.3 Ų | 32.3 | 55% | 0.545 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -62.9 | -35.4 | 177.1 | 167.5 | 0 | 0 | 0 | 0 | 112 | G241 L242 F243 P249 | G241-V245 WeakPolarHBondContact O-CB 3.07Å; G241-V245 VanDerWaalsContact O-CG2 3.27Å; G241-V245 WeakPolarHBondContact O-CG2 2.99Å; G241-V245 PolarHBondContact O-N 3.08Å; L242-V245 PolarHBondContact O-N 3.3Å; F243-V245 PolarHBondContact O-N 2.94Å; V245-P249 VanDerWaalsContact O-CD 3.26Å; V245-P249 WeakPolarHBondContact O-CD 3.26Å; V245-P249 WeakPolarHBondContact O-CG 3.41Å |
| 246 | C | 92.4 | Very high | 86.8 | Confident | 2 Ų | 2 | 37.7 Ų | 37.7 | 1% | 0.014 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -72.3 | -39.5 | 179 | -64.5 | 0 | 0 | 0 | 0 | 112.9 | L242 F243 A244 L277 S278 N281 | L242-C246 WeakPolarHBondContact O-CB 3.44Å; L242-C246 PolarHBondContact O-N 2.84Å; L242-C246 PolarHBondContact O-SG 3.06Å; F243-C246 PolarHBondContact O-N 2.03Å; A244-C246 VanDerWaalsContact C-N 3.29Å; A244-C246 PolarHBondContact O-N 3.42Å; C246-L277 VanDerWaalsContact CB-O 3.31Å; C246-L277 WeakPolarHBondContact CB-O 3.28Å; C246-L277 CarbonylContact O-C 3.57Å; C246-S278 VanDerWaalsContact O-CA 3.31Å; C246-S278 WeakPolarHBondContact O-CA 3.47Å; C246-S278 PolarHBondContact O-N 3.05Å; C246-N281 HydrophobicContact CB-CB 3.74Å |
| 247 | W | 90.9 | Very high | 88.1 | Confident | 19 Ų | 19 | 38.2 Ų | 38.2 | 7% | 0.072 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -100.6 | -35.4 | -169.5 | -75.2 | 93.6 | 0 | 0 | 0 | 115.3 | T88 F243 A244 P249 L250 H251 | T88-W247 HydrophobicContact CG2-CD2 4.23Å; T88-W247 HydrophobicContact CG2-CE3 3.88Å; T88-W247 HydrophobicContact CG2-CH2 3.42Å; T88-W247 VanDerWaalsContact CG2-CH2 3.42Å; T88-W247 HydrophobicContact CG2-CZ2 3.77Å; T88-W247 HydrophobicContact CG2-CZ3 3.46Å; T88-W247 VanDerWaalsContact CG2-CZ3 3.46Å; T88-W247 WeakPolarHBondContact OG1-CH2 3.01Å; F243-W247 AromaticContact CD2-CD1 3.65Å; F243-W247 AromaticContact CD2-NE1 3.96Å; F243-W247 HydrophobicContact CE1-CB 4.25Å; F243-W247 AromaticContact CE1-CD1 3.86Å; F243-W247 HydrophobicContact CE1-CG 4.14Å; F243-W247 AromaticContact CE2-CD1 3.27Å; F243-W247 HydrophobicContact CE2-CG 4.13Å; F243-W247 AromaticContact CE2-NE1 3.41Å; F243-W247 HydrophobicContact CZ-CB 4.35Å; F243-W247 AromaticContact CZ-CD1 3.36Å; F243-W247 HydrophobicContact CZ-CD2 4.43Å; F243-W247 AromaticContact CZ-CG 3.78Å; F243-W247 HydrophobicContact CZ-CG 3.78Å; F243-W247 AromaticContact CZ-NE1 3.81Å; F243-W247 PolarHBondContact O-N 3.49Å; A244-W247 PolarHBondContact O-N 2.93Å; W247-P249 VanDerWaalsContact C-CD 3.46Å; W247-L250 PolarHBondContact O-N 3.04Å; W247-H251 AromaticContact CE3-NE2 3.94Å; W247-H251 PolarHBondContact O-CD2 2.95Å; W247-H251 PolarHBondContact O-N 2.87Å |
| 248 | L | 93.3 | Very high | 89.3 | Confident | 51 Ų | 51 | 37.3 Ų | 37.3 | 27% | 0.267 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -59.3 | -38.6 | -175.6 | -69.6 | 176.9 | 0 | 0 | 0 | 114.2 | F183 L191 A244 L250 H251 I252 | F183-L248 HydrophobicContact CE2-CD2 3.79Å; F183-L248 HydrophobicContact CZ-CD2 3.99Å; L191-L248 HydrophobicContact CD2-CD2 4.19Å; L191-L248 HydrophobicContact CD2-CG 4.47Å; A244-L248 HydrophobicContact CB-CD1 3.95Å; A244-L248 HydrophobicContact CB-CG 4.4Å; A244-L248 WeakPolarHBondContact O-CB 3.45Å; A244-L248 WeakPolarHBondContact O-CG 3.27Å; A244-L248 PolarHBondContact O-N 3.44Å; L248-L250 PolarHBondContact O-N 2.97Å; L248-H251 PolarHBondContact O-N 2.93Å; L248-I252 HydrophobicContact CB-CD1 4.18Å; L248-I252 WeakPolarHBondContact O-CB 3.21Å; L248-I252 WeakPolarHBondContact O-CD1 3.41Å; L248-I252 WeakPolarHBondContact O-CG1 3.2Å; L248-I252 PolarHBondContact O-N 3.33Å |
| 249 | P | 95.8 | Very high | 90.2 | Very high | 43 Ų | 43 | 38.8 Ų | 38.8 | 28% | 0.279 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -56.9 | -45.5 | -179.7 | -28.7 | 38.3 | 0 | 0 | 0 | 113.3 | V245 W247 I252 I253 A274 L277 | V245-P249 VanDerWaalsContact O-CD 3.26Å; V245-P249 WeakPolarHBondContact O-CD 3.26Å; V245-P249 WeakPolarHBondContact O-CG 3.41Å; W247-P249 VanDerWaalsContact C-CD 3.46Å; P249-I252 PolarHBondContact O-N 3.37Å; P249-I253 WeakPolarHBondContact O-CD1 3.28Å; P249-I253 VanDerWaalsContact O-CG1 3.25Å; P249-I253 WeakPolarHBondContact O-CG1 3.42Å; P249-I253 PolarHBondContact O-N 3.42Å; P249-A274 HydrophobicContact CB-CB 4.48Å; P249-L277 HydrophobicContact CG-CD2 3.92Å |
| 250 | L | 94.2 | Very high | 91.1 | Very high | 26 Ų | 26 | 39.4 Ų | 39.4 | 14% | 0.136 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.1 | -42.6 | 179.1 | -175.4 | 61.8 | 0 | 0 | 0 | 111.9 | W247 L248 I253 N254 M271 A274 I275 | W247-L250 PolarHBondContact O-N 3.04Å; L248-L250 PolarHBondContact O-N 2.97Å; L250-I253 PolarHBondContact O-N 2.96Å; L250-N254 PolarHBondContact O-N 2.88Å; L250-N254 PolarHBondContact O-ND2 3.22Å; L250-M271 HydrophobicContact CD1-CE 4.44Å; L250-A274 HydrophobicContact CB-CB 4.14Å; L250-A274 HydrophobicContact CD1-CB 4.11Å; L250-I275 HydrophobicContact CD1-CG1 4.11Å |
| 251 | H | 94.8 | Very high | 91.8 | Very high | 3 Ų | 3 | 44.1 Ų | 44.1 | 1% | 0.014 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -68.4 | -37.2 | 177.3 | -69.7 | -64.4 | 0 | 0 | 0 | 113.2 | N182 F183 W247 L248 I253 N254 C255 | N182-H251 PolarHBondContact OD1-CE1 3.4Å; F183-H251 HydrophobicContact CB-CB 4.22Å; F183-H251 WeakPolarHBondContact CB-ND1 3.43Å; F183-H251 HydrophobicContact CD1-CB 3.84Å; F183-H251 HydrophobicContact CD2-CB 3.39Å; F183-H251 AromaticContact CD2-CD2 3.71Å; F183-H251 AromaticContact CD2-CG 3.33Å; F183-H251 AromaticContact CD2-ND1 3.7Å; F183-H251 HydrophobicContact CE1-CB 3.97Å; F183-H251 HydrophobicContact CE2-CB 3.56Å; F183-H251 AromaticContact CE2-CG 3.88Å; F183-H251 HydrophobicContact CG-CB 3.55Å; F183-H251 AromaticContact CG-CG 3.68Å; F183-H251 AromaticContact CG-ND1 3.73Å; F183-H251 HydrophobicContact CZ-CB 3.85Å; W247-H251 AromaticContact CE3-NE2 3.94Å; W247-H251 PolarHBondContact O-CD2 2.95Å; W247-H251 PolarHBondContact O-N 2.87Å; L248-H251 PolarHBondContact O-N 2.93Å; H251-I253 VanDerWaalsContact C-N 3.3Å; H251-I253 PolarHBondContact O-N 3.43Å; H251-N254 PolarHBondContact O-N 3.28Å; H251-C255 PolarHBondContact O-N 2.81Å; H251-C255 PolarHBondContact O-SG 2.96Å; H251-C255 VanDerWaalsContact O-SG 3.34Å |
| 252 | I | 95.3 | Very high | 92.3 | Very high | 81 Ų | 81 | 51.4 Ų | 51.4 | 42% | 0.415 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -61.9 | -41.6 | 174 | -72 | 164.2 | 0 | 0 | 0 | 110 | L248 P249 C255 F256 | L248-I252 HydrophobicContact CB-CD1 4.18Å; L248-I252 WeakPolarHBondContact O-CB 3.21Å; L248-I252 WeakPolarHBondContact O-CD1 3.41Å; L248-I252 WeakPolarHBondContact O-CG1 3.2Å; L248-I252 PolarHBondContact O-N 3.33Å; P249-I252 PolarHBondContact O-N 3.37Å; I252-C255 WeakPolarHBondContact O-CB 3.47Å; I252-C255 PolarHBondContact O-N 3.45Å; I252-F256 HydrophobicContact CG2-CD2 3.85Å; I252-F256 HydrophobicContact CG2-CE2 3.72Å; I252-F256 VanDerWaalsContact O-CD2 3.31Å; I252-F256 WeakPolarHBondContact O-CD2 3.46Å; I252-F256 PolarHBondContact O-N 3.41Å |
| 253 | I | 95 | Very high | 92.6 | Very high | 19 Ų | 19 | 51.4 Ų | 51.4 | 10% | 0.097 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.1 | -44.4 | 175.4 | -64.9 | 159.7 | 0 | 0 | 0 | 111.2 | P249 L250 H251 C255 F256 T257 P266 I270 M271 A274 | P249-I253 WeakPolarHBondContact O-CD1 3.28Å; P249-I253 VanDerWaalsContact O-CG1 3.25Å; P249-I253 WeakPolarHBondContact O-CG1 3.42Å; P249-I253 PolarHBondContact O-N 3.42Å; L250-I253 PolarHBondContact O-N 2.96Å; H251-I253 VanDerWaalsContact C-N 3.3Å; H251-I253 PolarHBondContact O-N 3.43Å; I253-C255 VanDerWaalsContact C-N 3.27Å; I253-C255 PolarHBondContact O-N 3.33Å; I253-F256 PolarHBondContact O-N 2.72Å; I253-F256 VanDerWaalsContact O-N 3.1Å; I253-T257 PolarHBondContact O-N 3.04Å; I253-T257 PolarHBondContact O-OG1 3.15Å; I253-P266 HydrophobicContact CG2-CB 4.13Å; I253-P266 HydrophobicContact CG2-CG 3.49Å; I253-P266 VanDerWaalsContact CG2-CG 3.49Å; I253-I270 HydrophobicContact CD1-CG2 3.81Å; I253-M271 HydrophobicContact CB-SD 4.34Å; I253-M271 HydrophobicContact CD1-SD 4.3Å; I253-M271 HydrophobicContact CG2-SD 3.41Å; I253-M271 WeakPolarHBondContact CG2-SD 3.48Å; I253-A274 HydrophobicContact CD1-CB 3.66Å |
| 254 | N | 94.5 | Very high | 92.9 | Very high | 4 Ų | 4 | 57.2 Ų | 57.2 | 2% | 0.021 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -59.2 | -38 | 174.4 | -66.3 | -24.9 | 0 | 0 | 0 | 112.2 | V179 L250 H251 T257 L258 | V179-N254 HydrophobicContact CG2-CB 4.04Å; V179-N254 WeakPolarHBondContact CG2-O 3.45Å; L250-N254 PolarHBondContact O-N 2.88Å; L250-N254 PolarHBondContact O-ND2 3.22Å; H251-N254 PolarHBondContact O-N 3.28Å; N254-T257 PolarHBondContact O-N 2.99Å; N254-L258 PolarHBondContact O-N 3.3Å |
| 255 | C | 95.6 | Very high | 92.9 | Very high | 19 Ų | 19 | 65.7 Ų | 65.7 | 13% | 0.128 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -62.3 | -45.4 | 172.3 | -70.4 | 0 | 0 | 0 | 0 | 112.2 | H251 I252 I253 T257 L258 F259 | H251-C255 PolarHBondContact O-N 2.81Å; H251-C255 PolarHBondContact O-SG 2.96Å; H251-C255 VanDerWaalsContact O-SG 3.34Å; I252-C255 WeakPolarHBondContact O-CB 3.47Å; I252-C255 PolarHBondContact O-N 3.45Å; I253-C255 VanDerWaalsContact C-N 3.27Å; I253-C255 PolarHBondContact O-N 3.33Å; C255-T257 PolarHBondContact O-N 3.32Å; C255-L258 PolarHBondContact O-N 2.88Å; C255-F259 HydrophobicContact CB-CD2 3.9Å; C255-F259 HydrophobicContact CB-CE2 3.98Å; C255-F259 WeakPolarHBondContact O-CB 3.4Å; C255-F259 WeakPolarHBondContact O-CD2 3.29Å; C255-F259 WeakPolarHBondContact O-CG 3.27Å; C255-F259 PolarHBondContact O-N 3.24Å |
| 256 | F | 93.9 | Very high | 92.8 | Very high | 128 Ų | 128 | 63.2 Ų | 63.2 | 56% | 0.561 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -59.6 | -45.6 | 174.9 | -86.2 | -74.1 | 0 | 0 | 0 | 111.7 | I252 I253 L258 C260 | I252-F256 HydrophobicContact CG2-CD2 3.85Å; I252-F256 HydrophobicContact CG2-CE2 3.72Å; I252-F256 VanDerWaalsContact O-CD2 3.31Å; I252-F256 WeakPolarHBondContact O-CD2 3.46Å; I252-F256 PolarHBondContact O-N 3.41Å; I253-F256 PolarHBondContact O-N 2.72Å; I253-F256 VanDerWaalsContact O-N 3.1Å; F256-L258 VanDerWaalsContact C-N 3.29Å; F256-L258 PolarHBondContact O-N 3.36Å; F256-C260 PolarHBondContact O-N 2.91Å |
| 257 | T | 91.6 | Very high | 92.7 | Very high | 32 Ų | 32 | 66.2 Ų | 66.2 | 20% | 0.196 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -65.5 | -28 | 179.9 | -59.1 | 0 | 0 | 0 | 0 | 113 | M175 I253 N254 C255 | M175-T257 HydrophobicContact CE-CG2 4.02Å; I253-T257 PolarHBondContact O-N 3.04Å; I253-T257 PolarHBondContact O-OG1 3.15Å; N254-T257 PolarHBondContact O-N 2.99Å; C255-T257 PolarHBondContact O-N 3.32Å |
| 258 | L | 93.5 | Very high | 92.6 | Very high | 41 Ų | 41 | 69.3 Ų | 69.3 | 22% | 0.215 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -85.5 | -48.5 | 174.7 | -177.6 | 63.7 | 0 | 0 | 0 | 113.1 | M175 E176 V179 Y180 N254 C255 F256 | M175-L258 HydrophobicContact CB-CB 4.33Å; M175-L258 HydrophobicContact CB-CD1 3.99Å; E176-L258 HydrophobicContact CG-CD1 4.05Å; V179-L258 HydrophobicContact CB-CD2 3.59Å; V179-L258 HydrophobicContact CG1-CD2 3.93Å; V179-L258 HydrophobicContact CG2-CB 4.04Å; V179-L258 HydrophobicContact CG2-CD2 3.76Å; Y180-L258 HydrophobicContact CD2-CD2 4.43Å; Y180-L258 HydrophobicContact CE2-CD2 3.98Å; N254-L258 PolarHBondContact O-N 3.3Å; C255-L258 PolarHBondContact O-N 2.88Å; F256-L258 VanDerWaalsContact C-N 3.29Å; F256-L258 PolarHBondContact O-N 3.36Å |
| 259 | F | 95.6 | Very high | 92.5 | Very high | 104 Ų | 104 | 73.5 Ų | 73.5 | 46% | 0.456 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -86.8 | -15.8 | -169.9 | -61.6 | -54.3 | 0 | 0 | 0 | 114.2 | V179 Y180 F184 C255 | V179-F259 HydrophobicContact CG1-CE2 3.7Å; V179-F259 HydrophobicContact CG1-CZ 3.66Å; Y180-F259 HydrophobicContact CE1-CE1 4.07Å; Y180-F259 HydrophobicContact CE1-CZ 4.01Å; Y180-F259 AromaticContact CZ-CE1 3.96Å; F184-F259 HydrophobicContact CE2-CZ 4.16Å; F184-F259 HydrophobicContact CZ-CE2 4.1Å; F184-F259 HydrophobicContact CZ-CZ 4.18Å; C255-F259 HydrophobicContact CB-CD2 3.9Å; C255-F259 HydrophobicContact CB-CE2 3.98Å; C255-F259 WeakPolarHBondContact O-CB 3.4Å; C255-F259 WeakPolarHBondContact O-CD2 3.29Å; C255-F259 WeakPolarHBondContact O-CG 3.27Å; C255-F259 PolarHBondContact O-N 3.24Å |
| 260 | C | 93.4 | Very high | 92.3 | Very high | 40 Ų | 40 | 74.1 Ų | 74.1 | 27% | 0.27 | 38% | 0.383 | S | S | . | . | trans | -126.7 | 75.3 | 173.5 | -166.7 | 0 | 0 | 0 | 0 | 111.2 | F256 E262 C263 | F256-C260 PolarHBondContact O-N 2.91Å; C260-E262 PolarHBondContact O-N 2.85Å; C260-C263 HydrophobicContact CB-CB 3.69Å; C260-C263 WeakPolarHBondContact CB-SG 3.46Å; C260-C263 WeakPolarHBondContact O-CB 3.44Å; C260-C263 PolarHBondContact O-N 3.12Å; C260-C263 VanDerWaalsContact O-N 3.09Å; C260-C263 WeakPolarHBondContact SG-CB 3.44Å; C260-C263 PolarHBondContact SG-N 3.31Å; C260-C263 CovalentContact SG-SG 2.03Å; C260-C263 PolarHBondContact SG-SG 2.99Å | ||
| 261 | P | 89.2 | Confident | 92.2 | Very high | 113 Ų | 113 | 74.4 Ų | 74.4 | 73% | 0.734 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.6 | -21.4 | 177.8 | 27.8 | -35.6 | 0 | 0 | 0 | 113.2 | ||
| 262 | E | 92.3 | Very high | 92.1 | Very high | 188 Ų | 188 | 75.9 Ų | 75.9 | 88% | 0.879 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.1 | -13.9 | 175.9 | -62 | 178.1 | -174.3 | 0 | 0 | 113.3 | C260 | C260-E262 PolarHBondContact O-N 2.85Š|
| 263 | C | 90.9 | Very high | 92.1 | Very high | 55 Ų | 55 | 75.9 Ų | 75.9 | 37% | 0.372 | 39% | 0.393 | S | S | . | . | S | Bend | trans | -71.3 | 146.8 | 178.2 | -75.5 | 0 | 0 | 0 | 0 | 110.9 | C260 R265 | C260-C263 HydrophobicContact CB-CB 3.69Å; C260-C263 WeakPolarHBondContact CB-SG 3.46Å; C260-C263 WeakPolarHBondContact O-CB 3.44Å; C260-C263 PolarHBondContact O-N 3.12Å; C260-C263 VanDerWaalsContact O-N 3.09Å; C260-C263 WeakPolarHBondContact SG-CB 3.44Å; C260-C263 PolarHBondContact SG-N 3.31Å; C260-C263 CovalentContact SG-SG 2.03Å; C260-C263 PolarHBondContact SG-SG 2.99Å; C263-R265 PolarHBondContact O-N 3.48Å |
| 264 | P | 89.4 | Confident | 92.1 | Very high | 125 Ų | 125 | 75.1 Ų | 75.1 | 81% | 0.812 | 39% | 0.39 | S | S | * | . | P | Polyproline II helix | trans | -54.1 | 132.5 | 166.8 | -23.4 | 33.7 | 0 | 0 | 0 | 110.6 | ||
| 265 | R | 87.9 | Confident | 92.1 | Very high | 196 Ų | 196 | 76.7 Ų | 76.7 | 74% | 0.74 | 40% | 0.398 | S | S | * | . | P | Polyproline II helix | trans | -60.8 | 144.6 | 177.5 | -74.1 | -167.1 | -176.1 | 160.6 | 6.1 | 110.8 | C263 | C263-R265 PolarHBondContact O-N 3.48Š|
| 266 | P | 88.9 | Confident | 92.1 | Very high | 38 Ų | 38 | 77.3 Ų | 77.3 | 25% | 0.247 | 40% | 0.4 | C | S | . | . | P | Polyproline II helix | trans | -52.6 | 134.2 | 173.9 | -20.5 | 27.1 | 0 | 0 | 0 | 111.3 | I253 M271 | I253-P266 HydrophobicContact CG2-CB 4.13Å; I253-P266 HydrophobicContact CG2-CG 3.49Å; I253-P266 VanDerWaalsContact CG2-CG 3.49Å; P266-M271 HydrophobicContact CB-CG 4.5Å |
| 267 | P | 91 | Very high | 92.2 | Very high | 65 Ų | 65 | 73.8 Ų | 73.8 | 42% | 0.422 | 39% | 0.386 | S | S | . | . | P | Polyproline II helix | trans | -53.9 | 143.4 | 170.4 | -27.4 | 34.1 | 0 | 0 | 0 | 112.2 | W269 I270 M271 | P267-W269 HydrophobicContact CB-CG 4.37Å; P267-W269 PolarHBondContact O-N 3.37Å; P267-W269 VanDerWaalsContact O-N 3.16Å; P267-I270 HydrophobicContact CB-CG1 4.31Å; P267-I270 HydrophobicContact CG-CD1 4.27Å; P267-I270 WeakPolarHBondContact O-CB 3.33Å; P267-I270 PolarHBondContact O-N 3.12Å; P267-M271 PolarHBondContact O-N 3.28Å |
| 268 | V | 88.6 | Confident | 92.3 | Very high | 84 Ų | 84 | 72.4 Ų | 72.4 | 51% | 0.509 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -56.4 | -36.5 | -175.2 | -176.8 | 0 | 0 | 0 | 0 | 112.3 | I270 M271 Y272 | V268-I270 VanDerWaalsContact C-N 3.29Å; V268-I270 PolarHBondContact O-N 3.31Å; V268-M271 WeakPolarHBondContact O-CB 3.44Å; V268-M271 PolarHBondContact O-N 3.13Å; V268-M271 VanDerWaalsContact O-N 3.16Å; V268-Y272 HydrophobicContact CG1-CD1 4.36Å; V268-Y272 HydrophobicContact CG1-CD2 4.07Å; V268-Y272 HydrophobicContact CG1-CE1 3.95Å; V268-Y272 HydrophobicContact CG1-CE2 3.63Å; V268-Y272 HydrophobicContact CG1-CG 4.42Å; V268-Y272 PolarHBondContact O-N 3.18Å |
| 269 | W | 90.3 | Very high | 92.3 | Very high | 139 Ų | 139 | 70.8 Ų | 70.8 | 53% | 0.527 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -62.3 | -31.7 | 176.1 | 71.1 | -100.4 | 0 | 0 | 0 | 113.3 | P267 V273 | P267-W269 HydrophobicContact CB-CG 4.37Å; P267-W269 PolarHBondContact O-N 3.37Å; P267-W269 VanDerWaalsContact O-N 3.16Å; W269-V273 HydrophobicContact CE3-CG2 4.39Å; W269-V273 WeakPolarHBondContact O-CB 3.47Å; W269-V273 VanDerWaalsContact O-CG2 3.28Å; W269-V273 WeakPolarHBondContact O-CG2 3.35Å; W269-V273 PolarHBondContact O-N 2.94Å |
| 270 | I | 93.1 | Very high | 92.3 | Very high | 57 Ų | 57 | 66.9 Ų | 66.9 | 29% | 0.292 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -68.5 | -42.5 | 174.9 | -57.7 | -169.2 | 0 | 0 | 0 | 109.9 | I253 P267 V268 V273 A274 | I253-I270 HydrophobicContact CD1-CG2 3.81Å; P267-I270 HydrophobicContact CB-CG1 4.31Å; P267-I270 HydrophobicContact CG-CD1 4.27Å; P267-I270 WeakPolarHBondContact O-CB 3.33Å; P267-I270 PolarHBondContact O-N 3.12Å; V268-I270 VanDerWaalsContact C-N 3.29Å; V268-I270 PolarHBondContact O-N 3.31Å; I270-V273 PolarHBondContact O-N 3.36Å; I270-A274 WeakPolarHBondContact O-CB 3.45Å; I270-A274 PolarHBondContact O-N 3.48Å |
| 271 | M | 91.4 | Very high | 92.2 | Very high | 32 Ų | 32 | 65.2 Ų | 65.2 | 16% | 0.158 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60.6 | -47.9 | 174.8 | -70.2 | -62.5 | -77.9 | 0 | 0 | 111.2 | L250 I253 P266 P267 V268 V273 A274 I275 | L250-M271 HydrophobicContact CD1-CE 4.44Å; I253-M271 HydrophobicContact CB-SD 4.34Å; I253-M271 HydrophobicContact CD1-SD 4.3Å; I253-M271 HydrophobicContact CG2-SD 3.41Å; I253-M271 WeakPolarHBondContact CG2-SD 3.48Å; P266-M271 HydrophobicContact CB-CG 4.5Å; P267-M271 PolarHBondContact O-N 3.28Å; V268-M271 WeakPolarHBondContact O-CB 3.44Å; V268-M271 PolarHBondContact O-N 3.13Å; V268-M271 VanDerWaalsContact O-N 3.16Å; M271-V273 PolarHBondContact O-N 3.45Å; M271-A274 PolarHBondContact O-N 2.9Å; M271-I275 WeakPolarHBondContact O-CD1 3.36Å; M271-I275 VanDerWaalsContact O-CG1 3.25Å; M271-I275 WeakPolarHBondContact O-CG1 3.39Å; M271-I275 PolarHBondContact O-N 2.94Å |
| 272 | Y | 92.9 | Very high | 92.4 | Very high | 33 Ų | 33 | 60 Ų | 60 | 13% | 0.129 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -59.8 | -43.4 | 176.1 | -70.5 | -18.8 | 0 | 0 | 0 | 112.6 | Y9 V268 A274 I275 I276 | Y9-Y272 HydrophobicContact CD1-CD1 4.23Å; Y9-Y272 HydrophobicContact CD1-CE1 4.11Å; Y9-Y272 AromaticContact CD2-CD1 3.76Å; Y9-Y272 HydrophobicContact CD2-CD1 3.76Å; Y9-Y272 HydrophobicContact CD2-CD2 4.3Å; Y9-Y272 HydrophobicContact CD2-CE1 4.46Å; Y9-Y272 AromaticContact CD2-CG 3.67Å; Y9-Y272 HydrophobicContact CD2-CG 3.67Å; Y9-Y272 HydrophobicContact CE1-CD1 4.38Å; Y9-Y272 HydrophobicContact CE1-CE1 4.27Å; Y9-Y272 AromaticContact CE2-CD1 3.95Å; Y9-Y272 HydrophobicContact CE2-CD1 3.95Å; Y9-Y272 HydrophobicContact CE2-CG 4.28Å; Y9-Y272 AromaticContact CG-CD1 3.94Å; Y9-Y272 HydrophobicContact CG-CD1 3.94Å; Y9-Y272 HydrophobicContact CG-CD2 4.06Å; Y9-Y272 HydrophobicContact CG-CE1 4.22Å; Y9-Y272 HydrophobicContact CG-CE2 4.33Å; Y9-Y272 AromaticContact CG-CG 3.85Å; Y9-Y272 HydrophobicContact CG-CG 3.85Å; V268-Y272 HydrophobicContact CG1-CD1 4.36Å; V268-Y272 HydrophobicContact CG1-CD2 4.07Å; V268-Y272 HydrophobicContact CG1-CE1 3.95Å; V268-Y272 HydrophobicContact CG1-CE2 3.63Å; V268-Y272 HydrophobicContact CG1-CG 4.42Å; V268-Y272 PolarHBondContact O-N 3.18Å; Y272-A274 VanDerWaalsContact C-N 3.35Å; Y272-A274 PolarHBondContact O-N 3.2Å; Y272-I275 PolarHBondContact O-N 3.32Å; Y272-I276 VanDerWaalsContact O-CB 3.31Å; Y272-I276 WeakPolarHBondContact O-CB 3.44Å; Y272-I276 VanDerWaalsContact O-CG1 3.26Å; Y272-I276 WeakPolarHBondContact O-CG1 3.43Å; Y272-I276 PolarHBondContact O-N 3.1Å |
| 273 | V | 94.8 | Very high | 92.5 | Very high | 81 Ų | 81 | 52 Ų | 52 | 49% | 0.491 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -62.2 | -41.6 | 175.3 | 167.9 | 0 | 0 | 0 | 0 | 111.4 | W269 I270 M271 L277 | W269-V273 HydrophobicContact CE3-CG2 4.39Å; W269-V273 WeakPolarHBondContact O-CB 3.47Å; W269-V273 VanDerWaalsContact O-CG2 3.28Å; W269-V273 WeakPolarHBondContact O-CG2 3.35Å; W269-V273 PolarHBondContact O-N 2.94Å; I270-V273 PolarHBondContact O-N 3.36Å; M271-V273 PolarHBondContact O-N 3.45Å; V273-L277 WeakPolarHBondContact O-CB 3.3Å; V273-L277 PolarHBondContact O-N 3.38Å |
| 274 | A | 95.6 | Very high | 92.6 | Very high | 3 Ų | 3 | 51.5 Ų | 51.5 | 3% | 0.025 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -67.8 | -35.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | P249 L250 I253 I270 M271 Y272 S278 | P249-A274 HydrophobicContact CB-CB 4.48Å; L250-A274 HydrophobicContact CB-CB 4.14Å; L250-A274 HydrophobicContact CD1-CB 4.11Å; I253-A274 HydrophobicContact CD1-CB 3.66Å; I270-A274 WeakPolarHBondContact O-CB 3.45Å; I270-A274 PolarHBondContact O-N 3.48Å; M271-A274 PolarHBondContact O-N 2.9Å; Y272-A274 VanDerWaalsContact C-N 3.35Å; Y272-A274 PolarHBondContact O-N 3.2Å; A274-S278 PolarHBondContact O-N 2.95Å; A274-S278 VanDerWaalsContact O-N 3.08Å |
| 275 | I | 94.1 | Very high | 92.6 | Very high | 38 Ų | 38 | 45.8 Ų | 45.8 | 20% | 0.195 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -71.5 | -48.1 | 175.6 | -65 | 162.9 | 0 | 0 | 0 | 110.7 | Y9 E13 L250 M271 Y272 L277 S278 H279 | Y9-I275 HydrophobicContact CE2-CG2 4.34Å; E13-I275 WeakPolarHBondContact OE1-CG2 3.41Å; L250-I275 HydrophobicContact CD1-CG1 4.11Å; M271-I275 WeakPolarHBondContact O-CD1 3.36Å; M271-I275 VanDerWaalsContact O-CG1 3.25Å; M271-I275 WeakPolarHBondContact O-CG1 3.39Å; M271-I275 PolarHBondContact O-N 2.94Å; Y272-I275 PolarHBondContact O-N 3.32Å; I275-L277 PolarHBondContact O-N 3.21Å; I275-S278 PolarHBondContact O-N 2.94Å; I275-S278 VanDerWaalsContact O-N 3.15Å; I275-S278 PolarHBondContact O-OG 2.04Å; I275-H279 VanDerWaalsContact CG2-CE1 3.46Å; I275-H279 WeakPolarHBondContact CG2-CE1 3.11Å; I275-H279 PolarHBondContact O-N 3.41Å |
| 276 | I | 95.4 | Very high | 92.9 | Very high | 32 Ų | 32 | 36.9 Ų | 36.9 | 16% | 0.164 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -54.4 | -43 | 173.9 | -76.6 | 171.2 | 0 | 0 | 0 | 110.5 | Y9 L12 E13 I16 Y272 H279 A280 | Y9-I276 HydrophobicContact CD2-CD1 3.77Å; Y9-I276 HydrophobicContact CD2-CG1 3.91Å; Y9-I276 HydrophobicContact CE2-CD1 4.38Å; Y9-I276 HydrophobicContact CE2-CG1 4.01Å; L12-I276 HydrophobicContact CB-CD1 3.96Å; L12-I276 HydrophobicContact CD1-CD1 3.92Å; E13-I276 HydrophobicContact CG-CG1 4.22Å; I16-I276 HydrophobicContact CD1-CG2 3.71Å; Y272-I276 VanDerWaalsContact O-CB 3.31Å; Y272-I276 WeakPolarHBondContact O-CB 3.44Å; Y272-I276 VanDerWaalsContact O-CG1 3.26Å; Y272-I276 WeakPolarHBondContact O-CG1 3.43Å; Y272-I276 PolarHBondContact O-N 3.1Å; I276-H279 PolarHBondContact O-N 3.2Å; I276-A280 VanDerWaalsContact O-CB 3.3Å; I276-A280 WeakPolarHBondContact O-CB 3.48Å; I276-A280 PolarHBondContact O-N 3.28Å |
| 277 | L | 95.4 | Very high | 93 | Very high | 53 Ų | 53 | 41.5 Ų | 41.5 | 28% | 0.277 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -69 | -35.2 | -179.2 | 179.5 | 53.7 | 0 | 0 | 0 | 112.7 | C246 P249 V273 I275 | C246-L277 VanDerWaalsContact CB-O 3.31Å; C246-L277 WeakPolarHBondContact CB-O 3.28Å; C246-L277 CarbonylContact O-C 3.57Å; P249-L277 HydrophobicContact CG-CD2 3.92Å; V273-L277 WeakPolarHBondContact O-CB 3.3Å; V273-L277 PolarHBondContact O-N 3.38Å; I275-L277 PolarHBondContact O-N 3.21Å |
| 278 | S | 94.3 | Very high | 92.9 | Very high | 3 Ų | 3 | 39.1 Ų | 39.1 | 2% | 0.021 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -71.4 | -40.1 | 174.3 | 73.8 | 0 | 0 | 0 | 0 | 112 | C246 A274 I275 N281 | C246-S278 VanDerWaalsContact O-CA 3.31Å; C246-S278 WeakPolarHBondContact O-CA 3.47Å; C246-S278 PolarHBondContact O-N 3.05Å; A274-S278 PolarHBondContact O-N 2.95Å; A274-S278 VanDerWaalsContact O-N 3.08Å; I275-S278 PolarHBondContact O-N 2.94Å; I275-S278 VanDerWaalsContact O-N 3.15Å; I275-S278 PolarHBondContact O-OG 2.04Å; S278-N281 WeakPolarHBondContact O-CB 3.25Å; S278-N281 PolarHBondContact O-N 3.26Å |
| 279 | H | 94.8 | Very high | 92.9 | Very high | 8 Ų | 8 | 36 Ų | 36 | 4% | 0.037 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -67.7 | -33.6 | 174.5 | -64.9 | 161.4 | 0 | 0 | 0 | 113.2 | E13 I16 I60 I275 I276 N281 S282 | E13-H279 VanDerWaalsContact CD-ND1 3.28Å; E13-H279 IonicContact OE1-CE1 3.59Å; E13-H279 IonicContact OE1-ND1 2.87Å; E13-H279 PolarHBondContact OE1-ND1 3.35Å; E13-H279 IonicContact OE2-CE1 3.81Å; E13-H279 IonicContact OE2-CG 2.71Å; E13-H279 IonicContact OE2-ND1 2.94Å; E13-H279 PolarHBondContact OE2-ND1 3.18Å; I16-H279 HydrophobicContact CG2-CB 3.98Å; I60-H279 HydrophobicContact CD1-CB 4.09Å; I60-H279 HydrophobicContact CG1-CB 4.29Å; I275-H279 VanDerWaalsContact CG2-CE1 3.46Å; I275-H279 WeakPolarHBondContact CG2-CE1 3.11Å; I275-H279 PolarHBondContact O-N 3.41Å; I276-H279 PolarHBondContact O-N 3.2Å; H279-N281 PolarHBondContact O-N 3.41Å; H279-N281 VanDerWaalsContact O-N 3.13Å; H279-S282 PolarHBondContact O-N 3.36Å; H279-S282 VanDerWaalsContact O-N 3.11Å |
| 280 | A | 94.1 | Very high | 92.8 | Very high | 22 Ų | 22 | 30.6 Ų | 30.6 | 18% | 0.182 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -59.2 | -24.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | I16 I276 S282 V283 I284 | I16-A280 HydrophobicContact CD1-CB 4.3Å; I276-A280 VanDerWaalsContact O-CB 3.3Å; I276-A280 WeakPolarHBondContact O-CB 3.48Å; I276-A280 PolarHBondContact O-N 3.28Å; A280-S282 PolarHBondContact O-N 3.4Å; A280-V283 WeakPolarHBondContact O-CB 3.46Å; A280-V283 PolarHBondContact O-N 3.19Å; A280-I284 WeakPolarHBondContact O-CG1 3.47Å; A280-I284 PolarHBondContact O-N 3.3Å |
| 281 | N | 91.9 | Very high | 92.5 | Very high | 4 Ų | 4 | 36.6 Ų | 36.6 | 2% | 0.021 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -51.8 | -41.7 | 172.9 | -175.5 | 73.6 | 0 | 0 | 0 | 112.6 | C246 S278 H279 V283 I284 | C246-N281 HydrophobicContact CB-CB 3.74Å; S278-N281 WeakPolarHBondContact O-CB 3.25Å; S278-N281 PolarHBondContact O-N 3.26Å; H279-N281 PolarHBondContact O-N 3.41Å; H279-N281 VanDerWaalsContact O-N 3.13Å; N281-V283 VanDerWaalsContact C-N 3.3Å; N281-V283 PolarHBondContact O-N 2.94Å; N281-I284 PolarHBondContact O-N 3.4Å |
| 282 | S | 93.1 | Very high | 92.1 | Very high | 4 Ų | 4 | 38.3 Ų | 38.3 | 3% | 0.028 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -67.8 | -28.3 | -179.3 | -64.5 | 0 | 0 | 0 | 0 | 113.1 | S20 N24 D52 H279 A280 | S20-S282 WeakPolarHBondContact OG-CB 3.25Å; N24-S282 PolarHBondContact ND2-O 3.49Å; D52-S282 WeakPolarHBondContact OD1-CA 3.43Å; D52-S282 WeakPolarHBondContact OD1-CB 3.06Å; D52-S282 PolarHBondContact OD1-OG 2.84Å; H279-S282 PolarHBondContact O-N 3.36Å; H279-S282 VanDerWaalsContact O-N 3.11Å; A280-S282 PolarHBondContact O-N 3.4Å |
| 283 | V | 95.1 | Very high | 91.7 | Very high | 21 Ų | 21 | 39.6 Ų | 39.6 | 13% | 0.127 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -75.1 | -36.6 | 174.3 | 177.5 | 0 | 0 | 0 | 0 | 111.5 | I16 F19 A280 N281 N285 P286 F287 | I16-V283 HydrophobicContact CB-CG2 4.33Å; I16-V283 HydrophobicContact CG2-CG2 3.74Å; I16-V283 VanDerWaalsContact O-CG2 3.32Å; I16-V283 WeakPolarHBondContact O-CG2 3.23Å; F19-V283 HydrophobicContact CB-CG1 3.77Å; F19-V283 HydrophobicContact CB-CG2 4.01Å; A280-V283 WeakPolarHBondContact O-CB 3.46Å; A280-V283 PolarHBondContact O-N 3.19Å; N281-V283 VanDerWaalsContact C-N 3.3Å; N281-V283 PolarHBondContact O-N 2.94Å; V283-N285 PolarHBondContact O-N 3.26Å; V283-P286 WeakPolarHBondContact O-CD 3.47Å; V283-F287 HydrophobicContact CG1-CD2 4.42Å; V283-F287 HydrophobicContact CG1-CE2 3.86Å; V283-F287 VanDerWaalsContact O-CD2 3.26Å; V283-F287 WeakPolarHBondContact O-CD2 3.2Å |
| 284 | I | 92.4 | Very high | 91.3 | Very high | 44 Ų | 44 | 43.8 Ų | 43.8 | 23% | 0.226 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -66.4 | -34.9 | -172.1 | -73.6 | 165.9 | 0 | 0 | 0 | 112.5 | L242 A280 N281 F287 I288 | L242-I284 HydrophobicContact CD1-CG2 3.96Å; A280-I284 WeakPolarHBondContact O-CG1 3.47Å; A280-I284 PolarHBondContact O-N 3.3Å; N281-I284 PolarHBondContact O-N 3.4Å; I284-F287 PolarHBondContact O-N 3.11Å; I284-F287 VanDerWaalsContact O-N 3.08Å; I284-I288 HydrophobicContact CG2-CD1 3.66Å; I284-I288 HydrophobicContact CG2-CG1 3.89Å; I284-I288 PolarHBondContact O-N 3.09Å; I284-I288 VanDerWaalsContact O-N 3.1Å |
| 285 | N | 90.3 | Very high | 91 | Very high | 5 Ų | 5 | 47 Ų | 47 | 3% | 0.027 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -53.2 | -54.3 | -173.8 | -74 | -30.8 | 0 | 0 | 0 | 114 | D52 V283 F287 I288 Y289 | D52-N285 PolarHBondContact OD2-ND2 3.1Å; V283-N285 PolarHBondContact O-N 3.26Å; N285-F287 VanDerWaalsContact C-N 3.31Å; N285-F287 PolarHBondContact O-N 3.35Å; N285-I288 WeakPolarHBondContact O-CB 3.27Å; N285-I288 PolarHBondContact O-N 3.47Å; N285-I288 VanDerWaalsContact O-N 3.14Å; N285-Y289 HydrophobicContact CB-CE2 4.12Å; N285-Y289 VanDerWaalsContact O-CD2 3.26Å; N285-Y289 WeakPolarHBondContact O-CD2 3.13Å; N285-Y289 PolarHBondContact O-N 3.4Å; N285-Y289 VanDerWaalsContact O-N 3.11Å |
| 286 | P | 92.8 | Very high | 90.8 | Very high | 9 Ų | 9 | 45.1 Ų | 45.1 | 6% | 0.058 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -51.9 | -40.1 | 173 | -29.7 | 33.1 | 0 | 0 | 0 | 115.3 | G23 N24 V27 V283 Y289 A290 | G23-P286 WeakPolarHBondContact O-CG 3.2Å; N24-P286 WeakPolarHBondContact OD1-CD 3.3Å; N24-P286 WeakPolarHBondContact OD1-CG 3.2Å; V27-P286 HydrophobicContact CG2-CB 4.06Å; V27-P286 HydrophobicContact CG2-CG 3.93Å; V283-P286 WeakPolarHBondContact O-CD 3.47Å; P286-Y289 PolarHBondContact O-N 3.19Å; P286-A290 WeakPolarHBondContact O-CB 3.38Å; P286-A290 PolarHBondContact O-N 2.99Å |
| 287 | F | 91.6 | Very high | 90.7 | Very high | 134 Ų | 134 | 48.8 Ų | 48.8 | 59% | 0.588 | 22% | 0.22 | S | C | * | . | H | α-helix | trans | -68.8 | -38.3 | 178.9 | -68.2 | -83.5 | 0 | 0 | 0 | 111.9 | V283 I284 N285 A290 Y291 | V283-F287 HydrophobicContact CG1-CD2 4.42Å; V283-F287 HydrophobicContact CG1-CE2 3.86Å; V283-F287 VanDerWaalsContact O-CD2 3.26Å; V283-F287 WeakPolarHBondContact O-CD2 3.2Å; I284-F287 PolarHBondContact O-N 3.11Å; I284-F287 VanDerWaalsContact O-N 3.08Å; N285-F287 VanDerWaalsContact C-N 3.31Å; N285-F287 PolarHBondContact O-N 3.35Å; F287-A290 PolarHBondContact O-N 3.29Å; F287-Y291 WeakPolarHBondContact O-CB 3.46Å; F287-Y291 PolarHBondContact O-N 3.42Å |
| 288 | I | 88.6 | Confident | 90.6 | Very high | 16 Ų | 16 | 53 Ų | 53 | 8% | 0.082 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -59.5 | -48.4 | 172.9 | -62.7 | 178.9 | 0 | 0 | 0 | 109.8 | I239 L242 I284 N285 A290 Y291 R292 | I239-I288 HydrophobicContact CD1-CG2 3.91Å; I239-I288 HydrophobicContact CG1-CD1 3.79Å; I239-I288 HydrophobicContact CG1-CG2 3.73Å; L242-I288 HydrophobicContact CD1-CD1 3.72Å; L242-I288 HydrophobicContact CD1-CG1 4.31Å; I284-I288 HydrophobicContact CG2-CD1 3.66Å; I284-I288 HydrophobicContact CG2-CG1 3.89Å; I284-I288 PolarHBondContact O-N 3.09Å; I284-I288 VanDerWaalsContact O-N 3.1Å; N285-I288 WeakPolarHBondContact O-CB 3.27Å; N285-I288 PolarHBondContact O-N 3.47Å; N285-I288 VanDerWaalsContact O-N 3.14Å; I288-A290 PolarHBondContact O-N 2.83Å; I288-Y291 PolarHBondContact O-N 2.89Å; I288-R292 HydrophobicContact CG2-CG 3.94Å; I288-R292 VanDerWaalsContact O-CB 3.28Å; I288-R292 WeakPolarHBondContact O-CB 3.42Å; I288-R292 VanDerWaalsContact O-CG 3.27Å; I288-R292 WeakPolarHBondContact O-CG 3.47Å; I288-R292 PolarHBondContact O-N 2.98Å |
| 289 | Y | 88.2 | Confident | 90.5 | Very high | 17 Ų | 17 | 53.2 Ų | 53.2 | 7% | 0.067 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.5 | -41.7 | 179.3 | -51.4 | -37.1 | 0 | 0 | 0 | 111.9 | V27 V45 L48 N285 P286 Y291 I293 | V27-Y289 HydrophobicContact CG1-CD2 4.29Å; V27-Y289 HydrophobicContact CG1-CE2 4.28Å; V27-Y289 HydrophobicContact CG2-CD2 3.79Å; V27-Y289 HydrophobicContact CG2-CE2 4.18Å; V45-Y289 HydrophobicContact CG1-CD2 4.25Å; V45-Y289 HydrophobicContact CG1-CE1 4.37Å; V45-Y289 HydrophobicContact CG1-CE2 3.62Å; L48-Y289 WeakPolarHBondContact CD2-OH 3.46Å; N285-Y289 HydrophobicContact CB-CE2 4.12Å; N285-Y289 VanDerWaalsContact O-CD2 3.26Å; N285-Y289 WeakPolarHBondContact O-CD2 3.13Å; N285-Y289 PolarHBondContact O-N 3.4Å; N285-Y289 VanDerWaalsContact O-N 3.11Å; P286-Y289 PolarHBondContact O-N 3.19Å; Y289-Y291 PolarHBondContact O-N 3.47Å; Y289-I293 HydrophobicContact CD1-CD1 4.06Å; Y289-I293 WeakPolarHBondContact O-CB 3.27Å; Y289-I293 PolarHBondContact O-N 3.09Å |
| 290 | A | 89.3 | Confident | 90.5 | Very high | 27 Ų | 27 | 53.4 Ų | 53.4 | 22% | 0.223 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.5 | -37.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113 | P286 F287 I288 R297 F300 | P286-A290 WeakPolarHBondContact O-CB 3.38Å; P286-A290 PolarHBondContact O-N 2.99Å; F287-A290 PolarHBondContact O-N 3.29Å; I288-A290 PolarHBondContact O-N 2.83Å; A290-R297 VanDerWaalsContact O-CB 3.26Å; A290-R297 WeakPolarHBondContact O-CB 3.36Å; A290-R297 WeakPolarHBondContact O-CD 3.46Å; A290-R297 VanDerWaalsContact O-CG 3.3Å; A290-R297 WeakPolarHBondContact O-CG 3.37Å; A290-F300 HydrophobicContact CB-CD2 3.88Å; A290-F300 HydrophobicContact CB-CE2 3.93Å |
| 291 | Y | 87.3 | Confident | 90.3 | Very high | 182 Ų | 182 | 58.1 Ų | 58.1 | 71% | 0.714 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -83.9 | -38.5 | -178.9 | -168.9 | -116.9 | 0 | 0 | 0 | 113 | F287 I288 Y289 | F287-Y291 WeakPolarHBondContact O-CB 3.46Å; F287-Y291 PolarHBondContact O-N 3.42Å; I288-Y291 PolarHBondContact O-N 2.89Å; Y289-Y291 PolarHBondContact O-N 3.47Å |
| 292 | R | 81.8 | Confident | 90.3 | Very high | 69 Ų | 69 | 64.6 Ų | 64.6 | 26% | 0.26 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -93.2 | -32.5 | -171.6 | -55 | -55 | -64.1 | -165.7 | -4.4 | 114 | Q231 S235 I288 | Q231-R292 PolarHBondContact O-NH2 3.32Å; S235-R292 VanDerWaalsContact OG-CZ 3.28Å; S235-R292 PolarHBondContact OG-NE 3.17Å; S235-R292 PolarHBondContact OG-NH2 3.47Å; I288-R292 HydrophobicContact CG2-CG 3.94Å; I288-R292 VanDerWaalsContact O-CB 3.28Å; I288-R292 WeakPolarHBondContact O-CB 3.42Å; I288-R292 VanDerWaalsContact O-CG 3.27Å; I288-R292 WeakPolarHBondContact O-CG 3.47Å; I288-R292 PolarHBondContact O-N 2.98Å |
| 293 | I | 84.3 | Confident | 90.3 | Very high | 59 Ų | 59 | 64.5 Ų | 64.5 | 30% | 0.303 | 27% | 0.274 | S | S | . | . | trans | -109.6 | 115.5 | -173 | -50 | 172.4 | 0 | 0 | 0 | 110.2 | Y289 E295 F296 R297 | Y289-I293 HydrophobicContact CD1-CD1 4.06Å; Y289-I293 WeakPolarHBondContact O-CB 3.27Å; Y289-I293 PolarHBondContact O-N 3.09Å; I293-E295 VanDerWaalsContact C-N 3.27Å; I293-E295 HydrophobicContact CG2-CB 4.42Å; I293-E295 PolarHBondContact O-N 2.9Å; I293-F296 HydrophobicContact CB-CB 4.28Å; I293-F296 HydrophobicContact CB-CD2 3.97Å; I293-F296 HydrophobicContact CD1-CD2 3.78Å; I293-F296 HydrophobicContact CD1-CE2 4.1Å; I293-F296 HydrophobicContact CG1-CD2 4.47Å; I293-F296 HydrophobicContact CG2-CB 4.48Å; I293-F296 HydrophobicContact CG2-CD2 3.83Å; I293-F296 PolarHBondContact O-N 3.28Å; I293-R297 WeakPolarHBondContact O-CB 3.47Å; I293-R297 PolarHBondContact O-N 3.16Å | ||
| 294 | R | 87.2 | Confident | 90.1 | Very high | 169 Ų | 169 | 66.5 Ų | 66.5 | 64% | 0.638 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -64.8 | -33.3 | -173.1 | -66.4 | 178.9 | 173.5 | -164.1 | -3.3 | 112.1 | R297 R298 | R294-R297 PolarHBondContact O-N 2.99Å; R294-R298 WeakPolarHBondContact O-CB 3.43Å; R294-R298 VanDerWaalsContact O-CG 3.25Å; R294-R298 WeakPolarHBondContact O-CG 3.4Å; R294-R298 PolarHBondContact O-N 3.16Å |
| 295 | E | 89.2 | Confident | 89.9 | Confident | 70 Ų | 70 | 71.6 Ų | 71.6 | 33% | 0.327 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -74.1 | -44.6 | -175.3 | -71.5 | 50.4 | -114.1 | 0 | 0 | 110.6 | L37 I293 R298 T299 | L37-E295 HydrophobicContact CD2-CB 3.67Å; L37-E295 HydrophobicContact CG-CB 4.41Å; I293-E295 VanDerWaalsContact C-N 3.27Å; I293-E295 HydrophobicContact CG2-CB 4.42Å; I293-E295 PolarHBondContact O-N 2.9Å; E295-R298 PolarHBondContact O-N 2.92Å; E295-R298 IonicContact OE1-NH1 3.13Å; E295-R298 PolarHBondContact OE1-NH1 2.89Å; E295-R298 VanDerWaalsContact OE1-NH1 3.13Å; E295-T299 WeakPolarHBondContact O-CB 3.41Å; E295-T299 PolarHBondContact O-N 2.82Å; E295-T299 PolarHBondContact O-OG1 3.23Å |
| 296 | F | 90.9 | Very high | 89.7 | Confident | 0 Ų | 0 | 78.3 Ų | 78.3 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -58.5 | -52 | 167.7 | -86.3 | -73.5 | 0 | 0 | 0 | 110.7 | V27 A30 V31 L37 V45 I293 R298 T299 F300 | V27-F296 HydrophobicContact CG1-CE1 4.15Å; V27-F296 HydrophobicContact CG1-CZ 4.49Å; A30-F296 HydrophobicContact CB-CD1 4.09Å; A30-F296 HydrophobicContact CB-CE1 4.21Å; V31-F296 HydrophobicContact CG2-CE1 3.78Å; V31-F296 HydrophobicContact CG2-CZ 3.66Å; L37-F296 HydrophobicContact CD1-CD1 3.91Å; L37-F296 HydrophobicContact CD1-CE1 4.05Å; L37-F296 HydrophobicContact CD1-CG 4.18Å; L37-F296 HydrophobicContact CD1-CZ 4.44Å; L37-F296 HydrophobicContact CD2-CD2 3.88Å; L37-F296 HydrophobicContact CD2-CE2 3.94Å; L37-F296 HydrophobicContact CD2-CG 4.25Å; L37-F296 HydrophobicContact CD2-CZ 4.36Å; V45-F296 HydrophobicContact CG1-CZ 4.33Å; I293-F296 HydrophobicContact CB-CB 4.28Å; I293-F296 HydrophobicContact CB-CD2 3.97Å; I293-F296 HydrophobicContact CD1-CD2 3.78Å; I293-F296 HydrophobicContact CD1-CE2 4.1Å; I293-F296 HydrophobicContact CG1-CD2 4.47Å; I293-F296 HydrophobicContact CG2-CB 4.48Å; I293-F296 HydrophobicContact CG2-CD2 3.83Å; I293-F296 PolarHBondContact O-N 3.28Å; F296-R298 VanDerWaalsContact C-N 3.25Å; F296-R298 PolarHBondContact O-N 3.33Å; F296-T299 CarbonylContact O-C 3.57Å; F296-T299 PolarHBondContact O-N 2.71Å; F296-F300 HydrophobicContact CB-CE2 4.46Å; F296-F300 HydrophobicContact CB-CZ 4.36Å; F296-F300 AromaticContact CD1-CE1 3.7Å; F296-F300 HydrophobicContact CD1-CE1 3.7Å; F296-F300 AromaticContact CD1-CZ 3.73Å; F296-F300 HydrophobicContact CD1-CZ 3.73Å; F296-F300 HydrophobicContact CE1-CE1 4.43Å; F296-F300 HydrophobicContact CE1-CZ 4.5Å; F296-F300 HydrophobicContact CG-CZ 4.43Å; F296-F300 WeakPolarHBondContact O-CG 3.47Å; F296-F300 PolarHBondContact O-N 3.41Å |
| 297 | R | 92.6 | Very high | 89.4 | Confident | 108 Ų | 108 | 83.3 Ų | 83.3 | 41% | 0.408 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -57.5 | -33.4 | 178.6 | -166.9 | 175.9 | 55.6 | 175.3 | 0.2 | 114.2 | A290 I293 R294 R301 | A290-R297 VanDerWaalsContact O-CB 3.26Å; A290-R297 WeakPolarHBondContact O-CB 3.36Å; A290-R297 WeakPolarHBondContact O-CD 3.46Å; A290-R297 VanDerWaalsContact O-CG 3.3Å; A290-R297 WeakPolarHBondContact O-CG 3.37Å; I293-R297 WeakPolarHBondContact O-CB 3.47Å; I293-R297 PolarHBondContact O-N 3.16Å; R294-R297 PolarHBondContact O-N 2.99Å; R297-R301 WeakPolarHBondContact O-CG 3.25Å; R297-R301 PolarHBondContact O-N 3.19Å; R297-R301 PolarHBondContact O-NE 3.1Å |
| 298 | R | 92.3 | Very high | 89.1 | Confident | 141 Ų | 141 | 82.5 Ų | 82.5 | 53% | 0.532 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -72 | -42.2 | 173.6 | -79.6 | 166 | 167 | 167.9 | -12 | 110.9 | R294 E295 F296 K302 | R294-R298 WeakPolarHBondContact O-CB 3.43Å; R294-R298 VanDerWaalsContact O-CG 3.25Å; R294-R298 WeakPolarHBondContact O-CG 3.4Å; R294-R298 PolarHBondContact O-N 3.16Å; E295-R298 PolarHBondContact O-N 2.92Å; E295-R298 IonicContact OE1-NH1 3.13Å; E295-R298 PolarHBondContact OE1-NH1 2.89Å; E295-R298 VanDerWaalsContact OE1-NH1 3.13Å; F296-R298 VanDerWaalsContact C-N 3.25Å; F296-R298 PolarHBondContact O-N 3.33Å; R298-K302 WeakPolarHBondContact O-CG 3.47Å; R298-K302 PolarHBondContact O-N 3.33Å; R298-K302 VanDerWaalsContact O-N 3.16Å |
| 299 | T | 93.1 | Very high | 88.9 | Confident | 8 Ų | 8 | 86.7 Ų | 86.7 | 5% | 0.049 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -70.8 | -46.5 | -177.8 | -49 | 0 | 0 | 0 | 0 | 111.4 | A30 N34 L37 E295 F296 R301 K302 I303 | A30-T299 HydrophobicContact CB-CG2 3.69Å; N34-T299 HydrophobicContact CB-CG2 4.02Å; N34-T299 PolarHBondContact ND2-OG1 3.48Å; L37-T299 HydrophobicContact CD1-CG2 4.36Å; E295-T299 WeakPolarHBondContact O-CB 3.41Å; E295-T299 PolarHBondContact O-N 2.82Å; E295-T299 PolarHBondContact O-OG1 3.23Å; F296-T299 CarbonylContact O-C 3.57Å; F296-T299 PolarHBondContact O-N 2.71Å; T299-R301 PolarHBondContact O-N 2.91Å; T299-K302 WeakPolarHBondContact O-CA 3.31Å; T299-K302 WeakPolarHBondContact O-CB 3.35Å; T299-K302 PolarHBondContact O-N 3.04Å; T299-I303 HydrophobicContact CG2-CD1 4.12Å; T299-I303 WeakPolarHBondContact O-CG1 3.47Å; T299-I303 PolarHBondContact O-N 3.48Å |
| 300 | F | 93.9 | Very high | 88.1 | Confident | 13 Ų | 13 | 88.5 Ų | 88.5 | 6% | 0.057 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -54.5 | -48.3 | 173.7 | -67.2 | -8.8 | 0 | 0 | 0 | 112 | L26 V27 A30 A290 F296 K302 I303 I304 | L26-F300 HydrophobicContact CD1-CD1 4.17Å; L26-F300 HydrophobicContact CD2-CB 4.21Å; L26-F300 HydrophobicContact CD2-CD1 3.94Å; L26-F300 HydrophobicContact CD2-CD2 4.24Å; L26-F300 HydrophobicContact CD2-CE1 4.33Å; L26-F300 HydrophobicContact CD2-CG 3.89Å; L26-F300 HydrophobicContact CG-CD1 3.64Å; L26-F300 HydrophobicContact CG-CE1 3.83Å; L26-F300 HydrophobicContact CG-CG 4.14Å; L26-F300 HydrophobicContact CG-CZ 4.46Å; L26-F300 WeakPolarHBondContact O-CE1 3.41Å; V27-F300 HydrophobicContact CG2-CZ 3.94Å; A30-F300 HydrophobicContact CB-CD1 3.78Å; A30-F300 HydrophobicContact CB-CE1 3.56Å; A290-F300 HydrophobicContact CB-CD2 3.88Å; A290-F300 HydrophobicContact CB-CE2 3.93Å; F296-F300 HydrophobicContact CB-CE2 4.46Å; F296-F300 HydrophobicContact CB-CZ 4.36Å; F296-F300 AromaticContact CD1-CE1 3.7Å; F296-F300 HydrophobicContact CD1-CE1 3.7Å; F296-F300 AromaticContact CD1-CZ 3.73Å; F296-F300 HydrophobicContact CD1-CZ 3.73Å; F296-F300 HydrophobicContact CE1-CE1 4.43Å; F296-F300 HydrophobicContact CE1-CZ 4.5Å; F296-F300 HydrophobicContact CG-CZ 4.43Å; F296-F300 WeakPolarHBondContact O-CG 3.47Å; F296-F300 PolarHBondContact O-N 3.41Å; F300-K302 VanDerWaalsContact C-N 3.3Å; F300-K302 PolarHBondContact O-N 3.27Å; F300-I303 PolarHBondContact O-N 2.96Å; F300-I304 WeakPolarHBondContact O-CB 3.43Å; F300-I304 VanDerWaalsContact O-CG1 3.25Å; F300-I304 WeakPolarHBondContact O-CG1 3.4Å; F300-I304 PolarHBondContact O-N 2.77Å |
| 301 | R | 91.6 | Very high | 86.8 | Confident | 121 Ų | 121 | 96.4 Ų | 96.4 | 46% | 0.457 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -62.9 | -32.8 | 176.4 | -76.5 | -179.3 | -66.2 | 154.8 | -0.2 | 113.4 | R297 T299 R305 | R297-R301 WeakPolarHBondContact O-CG 3.25Å; R297-R301 PolarHBondContact O-N 3.19Å; R297-R301 PolarHBondContact O-NE 3.1Å; T299-R301 PolarHBondContact O-N 2.91Å; R301-R305 VanDerWaalsContact O-CB 3.28Å; R301-R305 WeakPolarHBondContact O-CB 3.13Å; R301-R305 VanDerWaalsContact O-CG 3.23Å; R301-R305 WeakPolarHBondContact O-CG 3.49Å; R301-R305 PolarHBondContact O-N 3.42Å; R301-R305 VanDerWaalsContact O-N 3.12Å |
| 302 | K | 91.8 | Very high | 85.4 | Confident | 139 Ų | 139 | 95.4 Ų | 95.4 | 60% | 0.604 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -67.8 | -45.3 | 173.1 | -75.4 | 177.5 | 175.9 | -174.2 | 0 | 111.3 | R298 T299 F300 R306 | R298-K302 WeakPolarHBondContact O-CG 3.47Å; R298-K302 PolarHBondContact O-N 3.33Å; R298-K302 VanDerWaalsContact O-N 3.16Å; T299-K302 WeakPolarHBondContact O-CA 3.31Å; T299-K302 WeakPolarHBondContact O-CB 3.35Å; T299-K302 PolarHBondContact O-N 3.04Å; F300-K302 VanDerWaalsContact C-N 3.3Å; F300-K302 PolarHBondContact O-N 3.27Å; K302-R306 WeakPolarHBondContact O-CB 3.36Å; K302-R306 PolarHBondContact O-N 3.34Å |
| 303 | I | 91.7 | Very high | 84.1 | Confident | 3 Ų | 3 | 95.9 Ų | 95.9 | 2% | 0.015 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -61.8 | -54.5 | 178.7 | -64.6 | 166.7 | 0 | 0 | 0 | 110.2 | L26 W29 A30 L33 T299 F300 R305 R306 H307 | L26-I303 HydrophobicContact CD1-CB 4.01Å; L26-I303 HydrophobicContact CD1-CD1 3.8Å; L26-I303 HydrophobicContact CD1-CG2 3.66Å; W29-I303 HydrophobicContact CD2-CD1 4.46Å; W29-I303 HydrophobicContact CD2-CG2 4.07Å; W29-I303 HydrophobicContact CE3-CG2 3.63Å; W29-I303 HydrophobicContact CG-CD1 4.33Å; W29-I303 HydrophobicContact CH2-CG2 3.98Å; W29-I303 HydrophobicContact CZ2-CG2 4.37Å; W29-I303 HydrophobicContact CZ3-CG2 3.59Å; A30-I303 HydrophobicContact CB-CD1 4.03Å; L33-I303 HydrophobicContact CD1-CD1 3.85Å; L33-I303 HydrophobicContact CD1-CG1 3.66Å; T299-I303 HydrophobicContact CG2-CD1 4.12Å; T299-I303 WeakPolarHBondContact O-CG1 3.47Å; T299-I303 PolarHBondContact O-N 3.48Å; F300-I303 PolarHBondContact O-N 2.96Å; I303-R305 VanDerWaalsContact C-N 3.35Å; I303-R305 PolarHBondContact O-N 3.22Å; I303-R306 PolarHBondContact O-N 3.4Å; I303-H307 WeakPolarHBondContact O-CB 3.03Å; I303-H307 PolarHBondContact O-N 2.94Å |
| 304 | I | 90.9 | Very high | 82.4 | Confident | 63 Ų | 63 | 98.8 Ų | 98.8 | 32% | 0.323 | 45% | 0.452 | S | S | . | . | I | π-helix | trans | -58.3 | -45.8 | -178.6 | -63.3 | 162.6 | 0 | 0 | 0 | 110.8 | L26 F300 I308 L309 | L26-I304 HydrophobicContact CD2-CD1 4.41Å; F300-I304 WeakPolarHBondContact O-CB 3.43Å; F300-I304 VanDerWaalsContact O-CG1 3.25Å; F300-I304 WeakPolarHBondContact O-CG1 3.4Å; F300-I304 PolarHBondContact O-N 2.77Å; I304-I308 HydrophobicContact CB-CD1 4.48Å; I304-I308 HydrophobicContact CG1-CD1 4.11Å; I304-I308 HydrophobicContact CG2-CB 4.49Å; I304-I308 WeakPolarHBondContact O-CB 3.43Å; I304-I308 PolarHBondContact O-N 3.01Å; I304-I308 VanDerWaalsContact O-N 3.17Å; I304-L309 HydrophobicContact CG2-CD1 4.07Å; I304-L309 HydrophobicContact CG2-CG 4.35Å; I304-L309 PolarHBondContact O-N 3.19Å |
| 305 | R | 89.7 | Confident | 80.6 | Confident | 151 Ų | 151 | 98.6 Ų | 98.6 | 57% | 0.57 | 46% | 0.462 | S | S | * | . | I | π-helix | trans | -65 | -47.7 | 179.1 | -74.4 | 177.9 | 177.1 | -165.9 | -4.4 | 113 | R301 I303 L309 G310 W311 | R301-R305 VanDerWaalsContact O-CB 3.28Å; R301-R305 WeakPolarHBondContact O-CB 3.13Å; R301-R305 VanDerWaalsContact O-CG 3.23Å; R301-R305 WeakPolarHBondContact O-CG 3.49Å; R301-R305 PolarHBondContact O-N 3.42Å; R301-R305 VanDerWaalsContact O-N 3.12Å; I303-R305 VanDerWaalsContact C-N 3.35Å; I303-R305 PolarHBondContact O-N 3.22Å; R305-L309 HydrophobicContact CG-CD1 4.45Å; R305-G310 PolarHBondContact O-N 3.11Å; R305-W311 WeakPolarHBondContact O-CB 3.04Å; R305-W311 PolarHBondContact O-N 2.87Å |
| 306 | R | 86.3 | Confident | 78.2 | Confident | 145 Ų | 145 | 102.6 Ų | 102.6 | 55% | 0.547 | 49% | 0.486 | S | S | . | . | I | π-helix | trans | -77.6 | -43.3 | -174.6 | -73.3 | -177.1 | 170.5 | -173.6 | -6.3 | 113.7 | K302 I303 | K302-R306 WeakPolarHBondContact O-CB 3.36Å; K302-R306 PolarHBondContact O-N 3.34Å; I303-R306 PolarHBondContact O-N 3.4Å |
| 307 | H | 85.8 | Confident | 75.6 | Confident | 114 Ų | 114 | 107.8 Ų | 107.8 | 53% | 0.528 | 52% | 0.522 | S | S | . | . | I | π-helix | trans | -104.5 | -22.5 | -168.4 | -62.4 | -71.6 | 0 | 0 | 0 | 114.5 | W29 I303 | W29-H307 HydrophobicContact CH2-CB 3.73Å; W29-H307 AromaticContact CH2-CG 3.87Å; W29-H307 HydrophobicContact CZ2-CB 4.34Å; W29-H307 AromaticContact CZ2-CD2 3.89Å; W29-H307 AromaticContact CZ2-CG 3.96Å; I303-H307 WeakPolarHBondContact O-CB 3.03Å; I303-H307 PolarHBondContact O-N 2.94Å |
| 308 | I | 84.5 | Confident | 72.9 | Confident | 117 Ų | 117 | 107.6 Ų | 107.6 | 60% | 0.6 | 54% | 0.537 | S | S | * | . | I | π-helix | trans | -103.8 | -47.2 | -179.9 | -53.5 | -178 | 0 | 0 | 0 | 110.8 | I304 | I304-I308 HydrophobicContact CB-CD1 4.48Å; I304-I308 HydrophobicContact CG1-CD1 4.11Å; I304-I308 HydrophobicContact CG2-CB 4.49Å; I304-I308 WeakPolarHBondContact O-CB 3.43Å; I304-I308 PolarHBondContact O-N 3.01Å; I304-I308 VanDerWaalsContact O-N 3.17Å |
| 309 | L | 84.2 | Confident | 70 | Confident | 105 Ų | 105 | 105 Ų | 105 | 55% | 0.55 | 55% | 0.554 | S | S | . | * | S | Bend | trans | -85.7 | -10.4 | 179 | -65.6 | 168.2 | 0 | 0 | 0 | 113.3 | I304 R305 W311 | I304-L309 HydrophobicContact CG2-CD1 4.07Å; I304-L309 HydrophobicContact CG2-CG 4.35Å; I304-L309 PolarHBondContact O-N 3.19Å; R305-L309 HydrophobicContact CG-CD1 4.45Å; L309-W311 PolarHBondContact O-N 2.79Å |
| 310 | G | 72.5 | Confident | 67.1 | Low | 55 Ų | 55 | 109.4 Ų | 109.4 | 57% | 0.567 | 59% | 0.586 | S | S | * | * | trans | 69.2 | 13.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | R305 H312 | R305-G310 PolarHBondContact O-N 3.11Å; G310-H312 VanDerWaalsContact C-N 3.35Å; G310-H312 PolarHBondContact O-N 3.08Å | ||
| 311 | W | 62.2 | Low | 64.2 | Low | 192 Ų | 192 | 118 Ų | 118 | 73% | 0.727 | 63% | 0.626 | S | S | * | * | trans | -74.6 | 88 | 179.3 | -77.1 | 43.3 | 0 | 0 | 0 | 110.2 | R305 L309 P313 | R305-W311 WeakPolarHBondContact O-CB 3.04Å; R305-W311 PolarHBondContact O-N 2.87Å; L309-W311 PolarHBondContact O-N 2.79Å; W311-P313 WeakPolarHBondContact O-CD 3.4Å | ||
| 312 | H | 57 | Low | 61.5 | Low | 162 Ų | 162 | 123 Ų | 123 | 75% | 0.75 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 122.2 | 154.9 | -107.4 | -101.5 | 0 | 0 | 0 | 108.3 | G310 V314 | G310-H312 VanDerWaalsContact C-N 3.35Å; G310-H312 PolarHBondContact O-N 3.08Å; H312-V314 PolarHBondContact O-N 2.85Å; H312-V314 VanDerWaalsContact O-N 3.14Å |
| 313 | P | 53.8 | Low | 58.5 | Low | 78 Ų | 78 | 124.4 Ų | 124.4 | 51% | 0.506 | 66% | 0.659 | S | S | . | * | P | Polyproline II helix | trans | -62.7 | 119.9 | 163.7 | 27.5 | -30.5 | 0 | 0 | 0 | 106.8 | W311 L315 | W311-P313 WeakPolarHBondContact O-CD 3.4Å; P313-L315 PolarHBondContact O-N 3Å; P313-L315 VanDerWaalsContact O-N 3.09Å |
| 314 | V | 49 | Very low | 55.5 | Low | 120 Ų | 120 | 129.4 Ų | 129.4 | 73% | 0.727 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 117.8 | 164 | 176.9 | 0 | 0 | 0 | 0 | 105.9 | H312 D316 | H312-V314 PolarHBondContact O-N 2.85Å; H312-V314 VanDerWaalsContact O-N 3.14Å; V314-D316 PolarHBondContact O-N 3.36Å; V314-D316 VanDerWaalsContact O-N 3.15Å |
| 315 | L | 50.4 | Low | 52.6 | Low | 165 Ų | 165 | 131.7 Ų | 131.7 | 86% | 0.864 | 71% | 0.711 | S | S | * | * | trans | -71.2 | 103.6 | 164.1 | -83 | 162.5 | 0 | 0 | 0 | 105.1 | P313 S317 | P313-L315 PolarHBondContact O-N 3Å; P313-L315 VanDerWaalsContact O-N 3.09Å; L315-S317 PolarHBondContact O-N 3.32Å | ||
| 316 | D | 38.2 | Very low | 49.8 | Very low | 155 Ų | 155 | 132.3 Ų | 132.3 | 83% | 0.829 | 72% | 0.72 | S | S | * | * | trans | -57.5 | 107.7 | 175.1 | -77.8 | -36 | 0 | 0 | 0 | 108.9 | V314 S318 | V314-D316 PolarHBondContact O-N 3.36Å; V314-D316 VanDerWaalsContact O-N 3.15Å; D316-S318 PolarHBondContact O-N 3.49Å | ||
| 317 | S | 36.6 | Very low | 47 | Very low | 108 Ų | 108 | 130.8 Ų | 130.8 | 76% | 0.755 | 73% | 0.727 | S | S | * | * | trans | -74 | 108.7 | 175.9 | 164.7 | 0 | 0 | 0 | 0 | 108.9 | L315 G319 | L315-S317 PolarHBondContact O-N 3.32Å; S317-G319 PolarHBondContact O-N 2.97Å | ||
| 318 | S | 35 | Very low | 44.2 | Very low | 104 Ų | 104 | 130.8 Ų | 130.8 | 73% | 0.727 | 74% | 0.736 | S | S | * | * | trans | 37.9 | 82.8 | 149.5 | -60.8 | 0 | 0 | 0 | 0 | 116.8 | D316 S320 | D316-S318 PolarHBondContact O-N 3.49Å; S318-S320 VanDerWaalsContact C-N 3.28Å; S318-S320 PolarHBondContact O-N 2.79Å | ||
| 319 | G | 32.6 | Very low | 41.7 | Very low | 86 Ų | 86 | 132.4 Ų | 132.4 | 89% | 0.887 | 74% | 0.744 | S | S | * | * | trans | -66.8 | 92.9 | 145.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | S317 E321 | S317-G319 PolarHBondContact O-N 2.97Å; G319-E321 PolarHBondContact O-N 3.33Å | ||
| 320 | S | 31.6 | Very low | 39 | Very low | 102 Ų | 102 | 133.8 Ų | 133.8 | 71% | 0.713 | 76% | 0.757 | S | S | * | * | trans | -83.2 | 91.7 | 179.2 | -170.5 | 0 | 0 | 0 | 0 | 110.6 | S318 | S318-S320 VanDerWaalsContact C-N 3.28Å; S318-S320 PolarHBondContact O-N 2.79Å | ||
| 321 | E | 32.8 | Very low | 36.8 | Very low | 193 Ų | 193 | 137.8 Ų | 137.8 | 90% | 0.902 | 77% | 0.765 | S | S | * | * | trans | -98.3 | 111.9 | 154.2 | -74 | -161.7 | 133.6 | 0 | 0 | 109.2 | G319 | G319-E321 PolarHBondContact O-N 3.33Š| ||
| 322 | R | 35.8 | Very low | 35.1 | Very low | 227 Ų | 227 | 134.1 Ų | 134.1 | 86% | 0.857 | 77% | 0.769 | S | S | * | * | trans | -69.7 | 126.8 | 167.8 | -75.1 | 171.5 | 165.9 | 163.6 | -5.7 | 108.4 | ||||
| 323 | N | 29.1 | Very low | 33.9 | Very low | 167 Ų | 167 | 133.4 Ų | 133.4 | 89% | 0.893 | 77% | 0.769 | S | S | * | * | trans | -145.5 | 132.2 | 130.7 | -97.6 | -33.8 | 0 | 0 | 0 | 110.9 | ||||
| 324 | S | 28.3 | Very low | 32.6 | Very low | 109 Ų | 109 | 141.4 Ų | 141.4 | 76% | 0.762 | 79% | 0.789 | S | S | * | * | trans | -67.7 | 152.8 | 171.9 | -146.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 325 | T | 30 | Very low | 31.6 | Very low | 110 Ų | 110 | 143.2 Ų | 143.2 | 68% | 0.675 | 79% | 0.794 | S | S | * | * | cis | -164.4 | 171.8 | 49.2 | 43.9 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 326 | H | 30.8 | Very low | 30.5 | Very low | 164 Ų | 164 | 144.3 Ų | 144.3 | 76% | 0.759 | 79% | 0.792 | S | S | * | * | trans | 88.6 | 105.5 | 157.3 | -86.4 | -76.2 | 0 | 0 | 0 | 120.5 | ||||
| 327 | T | 27.4 | Very low | 30.1 | Very low | 113 Ų | 113 | 140.6 Ų | 140.6 | 69% | 0.693 | 78% | 0.783 | S | S | * | * | 33.7 | 129.2 | 129.7 | 49.7 | 0 | 0 | 0 | 0 | 118.4 | |||||
| 328 | T | 25.7 | Very low | 29.8 | Very low | 115 Ų | 115 | 143 Ų | 143 | 71% | 0.706 | 79% | 0.787 | S | S | * | * | cis | -167.1 | 148.2 | 48.6 | -36.8 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 329 | I | 33.4 | Very low | 29.5 | Very low | 150 Ų | 150 | 141.8 Ų | 141.8 | 77% | 0.769 | 79% | 0.791 | S | S | * | * | trans | 17.2 | 117.6 | 152.7 | -59 | 160.8 | 0 | 0 | 0 | 118.4 | ||||
| 330 | T | 26.9 | Very low | 29.1 | Very low | 134 Ų | 134 | 145.8 Ų | 145.8 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | trans | -161.3 | 155.9 | 131.2 | -4.3 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 331 | D | 25.5 | Very low | 28.8 | Very low | 139 Ų | 139 | 148.4 Ų | 148.4 | 74% | 0.743 | 79% | 0.79 | S | S | * | * | trans | -57.9 | 150.7 | -175.7 | -58 | -83.8 | 0 | 0 | 0 | 116.2 | ||||
| 332 | S | 28.3 | Very low | 28.3 | Very low | 116 Ų | 116 | 146.6 Ų | 146.6 | 81% | 0.811 | 79% | 0.785 | S | S | * | * | -163.1 | 118 | 118.9 | 26.9 | 0 | 0 | 0 | 0 | 113.2 | R334 | S332-R334 PolarHBondContact O-N 2.03Š| |||
| 333 | I | 30.8 | Very low | 27.8 | Very low | 147 Ų | 147 | 141.5 Ų | 141.5 | 75% | 0.754 | 78% | 0.775 | S | S | * | * | trans | -45 | 116 | 166.5 | -64.4 | 154.1 | 0 | 0 | 0 | 110.6 | L335 | I333-L335 HydrophobicContact CG2-CD1 4.28Å; I333-L335 HydrophobicContact CG2-CG 3.98Å | ||
| 334 | R | 26.2 | Very low | 27.5 | Very low | 245 Ų | 245 | 141.1 Ų | 141.1 | 93% | 0.925 | 77% | 0.772 | S | S | * | * | trans | -100.6 | 85.7 | 166.5 | -154.7 | 175.5 | -160.6 | -166.2 | 5.3 | 109.9 | S332 | S332-R334 PolarHBondContact O-N 2.03Š| ||
| 335 | L | 28.7 | Very low | 27.3 | Very low | 159 Ų | 159 | 144.4 Ų | 144.4 | 83% | 0.832 | 77% | 0.773 | S | S | * | * | trans | -56.6 | 141.5 | 174.7 | -99.6 | 158.9 | 0 | 0 | 0 | 111.3 | I333 | I333-L335 HydrophobicContact CG2-CD1 4.28Å; I333-L335 HydrophobicContact CG2-CG 3.98Å | ||
| 336 | K | 27.6 | Very low | 27.1 | Very low | 188 Ų | 188 | 145.6 Ų | 145.6 | 82% | 0.817 | 78% | 0.78 | S | S | * | * | trans | -109.5 | 140.1 | -168.2 | -178.8 | 179.2 | -179 | 179.3 | 0 | 109.3 | ||||
| 337 | A | 28.6 | Very low | 26.8 | Very low | 77 Ų | 77 | 144.9 Ų | 144.9 | 64% | 0.636 | 78% | 0.777 | S | S | * | * | trans | 62.3 | 136.3 | 156.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 338 | N | 30.7 | Very low | 26.7 | Very low | 158 Ų | 158 | 146.8 Ų | 146.8 | 85% | 0.845 | 78% | 0.782 | S | S | * | * | cis | -161 | 151.3 | 27.3 | -94.2 | -32.4 | 0 | 0 | 0 | 109.6 | ||||
| 339 | G | 29.5 | Very low | 26.5 | Very low | 78 Ų | 78 | 145.1 Ų | 145.1 | 80% | 0.804 | 78% | 0.776 | S | S | * | * | trans | -82.8 | 124.1 | 161.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 340 | L | 23.8 | Very low | 26.1 | Very low | 170 Ų | 170 | 147.2 Ų | 147.2 | 89% | 0.89 | 78% | 0.779 | S | S | * | * | trans | -90.2 | 106.6 | 171.8 | -164.7 | 78 | 0 | 0 | 0 | 108.8 | ||||
| 341 | K | 24 | Very low | 25.8 | Very low | 158 Ų | 158 | 145.7 Ų | 145.7 | 69% | 0.687 | 77% | 0.774 | S | S | * | * | trans | -94.7 | 116 | 170.2 | -171.5 | 173.7 | -176.7 | -92.7 | 0 | 107.9 | D343 | K341-D343 IonicContact NZ-OD1 2.77Å; K341-D343 PolarHBondContact NZ-OD1 3.09Å; K341-D343 IonicContact NZ-OD2 2.65Å; K341-D343 PolarHBondContact NZ-OD2 3.24Å; K341-D343 PolarHBondContact O-N 3.34Å | ||
| 342 | L | 23.6 | Very low | 25.7 | Very low | 155 Ų | 155 | 144.1 Ų | 144.1 | 81% | 0.812 | 77% | 0.774 | S | S | * | * | trans | -93.1 | 87.6 | 179.8 | -174.1 | 72.6 | 0 | 0 | 0 | 109.2 | ||||
| 343 | D | 25 | Very low | 25.4 | Very low | 119 Ų | 119 | 143.4 Ų | 143.4 | 64% | 0.636 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -89 | 123.6 | 167.2 | -66.1 | -46.5 | 0 | 0 | 0 | 108.9 | K341 | K341-D343 IonicContact NZ-OD1 2.77Å; K341-D343 PolarHBondContact NZ-OD1 3.09Å; K341-D343 IonicContact NZ-OD2 2.65Å; K341-D343 PolarHBondContact NZ-OD2 3.24Å; K341-D343 PolarHBondContact O-N 3.34Å |
| 344 | L | 22.8 | Very low | 25 | Very low | 160 Ų | 160 | 141.6 Ų | 141.6 | 84% | 0.838 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -91.9 | 142.2 | -179 | -170 | 67.6 | 0 | 0 | 0 | 110.4 | ||
| 345 | F | 25 | Very low | 24.9 | Very low | 178 Ų | 178 | 138.6 Ų | 138.6 | 78% | 0.781 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -46.6 | 139.9 | -176.9 | -86.6 | -101.8 | 0 | 0 | 0 | 116 | E347 | F345-E347 HydrophobicContact CD1-CG 4.44Š|
| 346 | T | 24.3 | Very low | 24.7 | Very low | 134 Ų | 134 | 138.1 Ų | 138.1 | 82% | 0.822 | 76% | 0.763 | S | S | * | * | trans | -140.4 | 113.8 | 130.3 | -46.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 347 | E | 24.8 | Very low | 24.6 | Very low | 150 Ų | 150 | 133.7 Ų | 133.7 | 70% | 0.701 | 76% | 0.756 | S | S | * | * | trans | -83.5 | 128.5 | 170.6 | -108.1 | -85.8 | 177.6 | 0 | 0 | 109.5 | F345 | F345-E347 HydrophobicContact CD1-CG 4.44Š| ||
| 348 | L | 24.9 | Very low | 24.3 | Very low | 152 Ų | 152 | 135.3 Ų | 135.3 | 80% | 0.796 | 76% | 0.762 | S | S | * | * | trans | -159.5 | 89.1 | 163.5 | -125.5 | 129.7 | 0 | 0 | 0 | 113.4 | ||||
| 349 | S | 23 | Very low | 24.1 | Very low | 81 Ų | 81 | 133.7 Ų | 133.7 | 57% | 0.566 | 76% | 0.763 | S | S | * | * | trans | 11.6 | 125 | 148.9 | 67.4 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 350 | K | 23.4 | Very low | 23.8 | Very low | 194 Ų | 194 | 141.1 Ų | 141.1 | 84% | 0.843 | 77% | 0.767 | S | S | * | * | 169.6 | 136.3 | 106 | -94.8 | 177.1 | 178.6 | 177.1 | 0 | 114.7 | |||||
| 351 | S | 22.1 | Very low | 24.2 | Very low | 102 Ų | 102 | 138.5 Ų | 138.5 | 71% | 0.713 | 76% | 0.76 | S | S | * | * | trans | 11.2 | 134.7 | 148.7 | 59.2 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 352 | S | 23.1 | Very low | 24.3 | Very low | 106 Ų | 106 | 136.7 Ų | 136.7 | 74% | 0.741 | 76% | 0.762 | S | S | * | * | 165.5 | 152.1 | 98 | 48.4 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 353 | S | 21.6 | Very low | 24.4 | Very low | 100 Ų | 100 | 133.8 Ų | 133.8 | 70% | 0.699 | 76% | 0.755 | S | S | * | * | trans | 60.1 | 131.4 | 160.9 | 32.5 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 354 | C | 22 | Very low | 24.5 | Very low | 110 Ų | 110 | 135.5 Ų | 135.5 | 74% | 0.743 | 76% | 0.762 | S | S | * | * | 62.3 | 131 | 63.5 | -57.1 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 355 | E | 25 | Very low | 24.7 | Very low | 182 Ų | 182 | 133.2 Ų | 133.2 | 85% | 0.85 | 76% | 0.76 | S | S | * | * | cis | -160.9 | 171.9 | 9.2 | -92.8 | 147.1 | 109.6 | 0 | 0 | 107.1 | ||||
| 356 | D | 23.3 | Very low | 25.3 | Very low | 149 Ų | 149 | 130 Ų | 130 | 80% | 0.797 | 76% | 0.757 | S | S | * | * | cis | -169.5 | -144.5 | -26.8 | -171.6 | 63 | 0 | 0 | 0 | 107.3 | ||||
| 357 | S | 25.6 | Very low | 25.5 | Very low | 95 Ų | 95 | 130.6 Ų | 130.6 | 66% | 0.664 | 76% | 0.76 | S | S | * | * | trans | 75.4 | 87.5 | 164.9 | 69.1 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 358 | S | 23.6 | Very low | 25.5 | Very low | 111 Ų | 111 | 127 Ų | 127 | 78% | 0.776 | 76% | 0.763 | S | S | * | * | 31.9 | 126.9 | 121.3 | 65.6 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 359 | S | 25.5 | Very low | 25.6 | Very low | 123 Ų | 123 | 123.9 Ų | 123.9 | 86% | 0.86 | 77% | 0.767 | S | S | * | * | -169 | 132.2 | 102.6 | 47.7 | 0 | 0 | 0 | 0 | 113 | |||||
| 360 | R | 24.1 | Very low | 25.6 | Very low | 234 Ų | 234 | 123.3 Ų | 123.3 | 88% | 0.883 | 77% | 0.774 | S | S | * | * | trans | -98 | 159.2 | 162.2 | -130.2 | -178.9 | -159.5 | -176.9 | 6.9 | 106.7 | ||||
| 361 | P | 32.1 | Very low | 25.8 | Very low | 116 Ų | 116 | 122 Ų | 122 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | -147.2 | 164.2 | 88.9 | 36.8 | -18.5 | 0 | 0 | 0 | 116.9 | |||||
| 362 | T | 25.8 | Very low | 26 | Very low | 119 Ų | 119 | 123.4 Ų | 123.4 | 73% | 0.73 | 78% | 0.78 | S | S | * | * | trans | -12.6 | 158 | 151 | 50.9 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 363 | S | 25.4 | Very low | 26.1 | Very low | 94 Ų | 94 | 121.9 Ų | 121.9 | 66% | 0.657 | 77% | 0.774 | S | S | * | * | cis | 179.1 | 175.3 | -7.4 | 51.5 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 364 | I | 27.3 | Very low | 26.3 | Very low | 155 Ų | 155 | 124.1 Ų | 124.1 | 80% | 0.795 | 78% | 0.783 | S | S | * | * | trans | 154.6 | 126.9 | 138.3 | -79.5 | 154.7 | 0 | 0 | 0 | 109.9 | ||||
| 365 | S | 27.2 | Very low | 26.4 | Very low | 112 Ų | 112 | 123 Ų | 123 | 78% | 0.783 | 78% | 0.776 | S | S | * | * | trans | -129.4 | 156.7 | 159.2 | -58.6 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 366 | P | 37.3 | Very low | 26.5 | Very low | 110 Ų | 110 | 123 Ų | 123 | 71% | 0.714 | 78% | 0.776 | S | S | * | * | -125.2 | 142.8 | 124.3 | -0.5 | 22.2 | 0 | 0 | 0 | 111.6 | |||||
| 367 | V | 27.9 | Very low | 27.3 | Very low | 148 Ų | 148 | 121.5 Ų | 121.5 | 90% | 0.897 | 77% | 0.774 | S | S | * | * | 59.3 | 127.7 | 88.5 | -174.4 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 368 | G | 24.9 | Very low | 28.2 | Very low | 74 Ų | 74 | 122.1 Ų | 122.1 | 76% | 0.763 | 78% | 0.776 | S | S | * | * | cis | 166.3 | 172 | -1.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 369 | G | 26.6 | Very low | 28.2 | Very low | 86 Ų | 86 | 124.7 Ų | 124.7 | 89% | 0.887 | 78% | 0.78 | S | S | * | * | trans | 104.4 | 132.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 370 | G | 24.4 | Very low | 28.3 | Very low | 69 Ų | 69 | 123.9 Ų | 123.9 | 71% | 0.711 | 77% | 0.774 | S | S | * | * | cis | 137.1 | 114.5 | -7.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 371 | L | 26.5 | Very low | 28.4 | Very low | 166 Ų | 166 | 117.9 Ų | 117.9 | 87% | 0.869 | 76% | 0.764 | S | S | * | * | trans | 148.5 | 118.2 | 150.9 | -82.5 | 155.4 | 0 | 0 | 0 | 112 | ||||
| 372 | V | 26.4 | Very low | 28.2 | Very low | 133 Ų | 133 | 119.7 Ų | 119.7 | 81% | 0.806 | 77% | 0.766 | S | S | * | * | trans | 62.7 | 142 | 131.1 | 176.9 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 373 | A | 25.8 | Very low | 28.3 | Very low | 74 Ų | 74 | 120.8 Ų | 120.8 | 61% | 0.612 | 77% | 0.765 | S | S | * | * | cis | -175.7 | -179.6 | -27.6 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 374 | V | 26.7 | Very low | 28.3 | Very low | 147 Ų | 147 | 121.2 Ų | 121.2 | 89% | 0.891 | 77% | 0.769 | S | S | * | * | trans | 82.4 | 140.5 | 161.2 | -166.2 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 375 | S | 24.2 | Very low | 28.2 | Very low | 86 Ų | 86 | 120.5 Ų | 120.5 | 60% | 0.601 | 77% | 0.766 | S | S | * | * | trans | -126.2 | 139.4 | -162.6 | 51.7 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 376 | H | 25.7 | Very low | 28.5 | Very low | 182 Ų | 182 | 121.3 Ų | 121.3 | 84% | 0.843 | 77% | 0.77 | S | S | * | * | trans | 61.6 | 164.7 | 150.7 | -65.1 | -52.7 | 0 | 0 | 0 | 119.6 | ||||
| 377 | P | 39.6 | Very low | 28.3 | Very low | 118 Ų | 118 | 120.5 Ų | 120.5 | 77% | 0.766 | 77% | 0.765 | S | S | * | * | cis | -124.2 | -122.5 | -27.1 | 27.5 | -2.7 | 0 | 0 | 0 | 112.6 | ||||
| 378 | P | 45.9 | Very low | 28.3 | Very low | 107 Ų | 107 | 122 Ų | 122 | 70% | 0.695 | 76% | 0.763 | S | S | * | * | trans | -118.5 | -157.4 | -131.8 | 39.8 | -18.2 | 0 | 0 | 0 | 114.4 | ||||
| 379 | L | 24 | Very low | 28.4 | Very low | 165 Ų | 165 | 123.6 Ų | 123.6 | 86% | 0.864 | 77% | 0.768 | S | S | * | * | trans | 89.8 | 144.6 | -175.3 | -61.7 | 139.5 | 0 | 0 | 0 | 113 | ||||
| 380 | S | 27.8 | Very low | 28.3 | Very low | 106 Ų | 106 | 122.3 Ų | 122.3 | 74% | 0.741 | 76% | 0.755 | S | S | * | * | cis | -131.7 | 143.3 | 31.6 | 53.1 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 381 | V | 24.9 | Very low | 28.3 | Very low | 109 Ų | 109 | 126.1 Ų | 126.1 | 66% | 0.661 | 77% | 0.765 | S | S | * | * | trans | -79.7 | 137.3 | 158.3 | 169.8 | 0 | 0 | 0 | 0 | 108.4 | I383 | V381-I383 HydrophobicContact CG1-CD1 4.1Å; V381-I383 HydrophobicContact CG1-CG1 3.91Å | ||
| 382 | I | 28 | Very low | 28.2 | Very low | 154 Ų | 154 | 123.7 Ų | 123.7 | 79% | 0.79 | 76% | 0.76 | S | S | * | * | trans | -128.1 | 112 | 152.2 | -62.3 | -176.3 | 0 | 0 | 0 | 108.1 | ||||
| 383 | I | 27.7 | Very low | 28.2 | Very low | 141 Ų | 141 | 121.8 Ų | 121.8 | 72% | 0.723 | 76% | 0.759 | S | S | * | * | trans | -104 | 133.3 | 163 | -67.9 | 167.7 | 0 | 0 | 0 | 106.4 | V381 | V381-I383 HydrophobicContact CG1-CD1 4.1Å; V381-I383 HydrophobicContact CG1-CG1 3.91Å | ||
| 384 | S | 25.1 | Very low | 28.2 | Very low | 104 Ų | 104 | 125.1 Ų | 125.1 | 73% | 0.727 | 77% | 0.766 | S | S | * | * | trans | -142 | 94.7 | 166.9 | -173.8 | 0 | 0 | 0 | 0 | 106 | ||||
| 385 | N | 25.8 | Very low | 28.1 | Very low | 140 Ų | 140 | 126.5 Ų | 126.5 | 75% | 0.749 | 76% | 0.762 | S | S | * | * | 78.9 | 112 | 93.2 | -80.4 | -8.3 | 0 | 0 | 0 | 113.5 | |||||
| 386 | C | 32.7 | Very low | 28.2 | Very low | 128 Ų | 128 | 126 Ų | 126 | 87% | 0.865 | 76% | 0.764 | S | S | * | * | trans | -116.9 | 134.4 | 154.8 | 177.5 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 387 | P | 33.4 | Very low | 28.2 | Very low | 94 Ų | 94 | 125 Ų | 125 | 61% | 0.61 | 76% | 0.764 | S | S | * | * | trans | -147.2 | 146.2 | 143.9 | 35 | -18.3 | 0 | 0 | 0 | 116.2 | ||||
| 388 | Q | 27.9 | Very low | 27.6 | Very low | 180 Ų | 180 | 130.2 Ų | 130.2 | 84% | 0.841 | 77% | 0.768 | S | S | * | * | trans | 61.7 | 124.3 | 135.7 | -67.4 | 167.7 | -25.2 | 0 | 0 | 119.5 | ||||
| 389 | A | 27 | Very low | 26.6 | Very low | 106 Ų | 106 | 132.7 Ų | 132.7 | 88% | 0.876 | 77% | 0.77 | S | S | * | * | 77.9 | 138.3 | 64.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 390 | G | 24.8 | Very low | 26.8 | Very low | 60 Ų | 60 | 131.3 Ų | 131.3 | 62% | 0.619 | 77% | 0.769 | S | S | * | * | cis | 178.2 | -163.7 | -0.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 391 | T | 25.4 | Very low | 26.7 | Very low | 148 Ų | 148 | 133.2 Ų | 133.2 | 91% | 0.908 | 77% | 0.766 | S | S | * | * | trans | 63.4 | 154.4 | 170.7 | 61.4 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 392 | C | 23 | Very low | 27 | Very low | 115 Ų | 115 | 134.3 Ų | 134.3 | 78% | 0.777 | 77% | 0.767 | S | S | * | * | cis | -174.1 | 137.6 | -26 | 178.1 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 393 | A | 27 | Very low | 27.3 | Very low | 94 Ų | 94 | 132.7 Ų | 132.7 | 78% | 0.777 | 77% | 0.766 | S | S | * | * | trans | -178.7 | 120.9 | 151 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 394 | L | 26 | Very low | 27.3 | Very low | 144 Ų | 144 | 133.8 Ų | 133.8 | 75% | 0.754 | 77% | 0.773 | S | S | * | * | trans | 2.5 | 130.6 | 144.8 | -88 | 95.7 | 0 | 0 | 0 | 122.8 | ||||
| 395 | Q | 25.2 | Very low | 27.5 | Very low | 175 Ų | 175 | 133.4 Ų | 133.4 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | 94 | 136.4 | 117 | -154.9 | 176 | 7.3 | 0 | 0 | 121.5 | |||||
| 396 | A | 25.4 | Very low | 27.6 | Very low | 77 Ų | 77 | 137 Ų | 137 | 64% | 0.636 | 78% | 0.779 | S | S | * | * | trans | 102.4 | 113.8 | 146.2 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 397 | L | 25.8 | Very low | 27.4 | Very low | 160 Ų | 160 | 141 Ų | 141 | 84% | 0.838 | 78% | 0.776 | S | S | * | * | trans | 69.9 | 146.7 | 142.7 | -57.2 | 161.4 | 0 | 0 | 0 | 116.7 | ||||
| 398 | R | 26.3 | Very low | 27.2 | Very low | 228 Ų | 228 | 144.7 Ų | 144.7 | 86% | 0.86 | 79% | 0.789 | S | S | * | * | cis | -156 | 158.2 | 6.1 | -143.4 | 172.4 | -168.3 | 178.8 | 2.9 | 111.1 | ||||
| 399 | Q | 25.4 | Very low | 27.2 | Very low | 158 Ų | 158 | 139.3 Ų | 139.3 | 74% | 0.738 | 78% | 0.782 | S | S | * | * | trans | -77.2 | 148.3 | 165.3 | -63.2 | 153.6 | -76.1 | 0 | 0 | 112 | ||||
| 400 | T | 28.2 | Very low | 27.1 | Very low | 136 Ų | 136 | 143 Ų | 143 | 83% | 0.834 | 78% | 0.779 | S | S | * | * | trans | -160.1 | 110.8 | 145 | 44.3 | 0 | 0 | 0 | 0 | 104.3 | ||||
| 401 | E | 26.8 | Very low | 27.2 | Very low | 147 Ų | 147 | 147.4 Ų | 147.4 | 69% | 0.687 | 78% | 0.783 | S | S | * | * | cis | 64.5 | 119.1 | 39.1 | -90.8 | -155.5 | 153.6 | 0 | 0 | 116.1 | ||||
| 402 | I | 30 | Very low | 27.3 | Very low | 131 Ų | 131 | 148.8 Ų | 148.8 | 67% | 0.672 | 78% | 0.78 | S | S | * | * | trans | 80 | 146 | 134.7 | -75.7 | 174.5 | 0 | 0 | 0 | 116.7 | ||||
| 403 | P | 34.3 | Very low | 27.4 | Very low | 121 Ų | 121 | 154.7 Ų | 154.7 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | cis | -128.5 | 147.1 | 30.7 | 20.2 | 4.3 | 0 | 0 | 0 | 120.6 | ||||
| 404 | L | 28.4 | Very low | 27.5 | Very low | 164 Ų | 164 | 158.7 Ų | 158.7 | 86% | 0.859 | 79% | 0.788 | S | S | * | * | trans | -87.2 | 135.5 | 145.9 | -174.3 | 82.4 | 0 | 0 | 0 | 109 | ||||
| 405 | A | 29.4 | Very low | 27.6 | Very low | 96 Ų | 96 | 161 Ų | 161 | 79% | 0.793 | 80% | 0.795 | S | S | * | * | trans | -97.4 | 125.1 | 168.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 406 | R | 27.6 | Very low | 27.5 | Very low | 216 Ų | 216 | 155.7 Ų | 155.7 | 82% | 0.815 | 79% | 0.787 | S | S | * | * | trans | -44 | 165.5 | 161 | -67.9 | 178.9 | -177.3 | 173.2 | 1.8 | 113.5 | ||||
| 407 | R | 28.8 | Very low | 27.6 | Very low | 211 Ų | 211 | 161.4 Ų | 161.4 | 80% | 0.796 | 80% | 0.8 | S | S | * | * | cis | -169.1 | 165.4 | -4.5 | -116.6 | 177.6 | -175.4 | -147.3 | 0.3 | 108.8 | ||||
| 408 | L | 28.6 | Very low | 27.7 | Very low | 171 Ų | 171 | 158.1 Ų | 158.1 | 90% | 0.895 | 80% | 0.796 | S | S | * | * | trans | 145.5 | 113.7 | 148.4 | -80 | 167.4 | 0 | 0 | 0 | 104.8 | ||||
| 409 | G | 26.9 | Very low | 27.7 | Very low | 67 Ų | 67 | 150.6 Ų | 150.6 | 69% | 0.691 | 79% | 0.789 | S | S | * | * | cis | 77.3 | 114.9 | 42.7 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 410 | F | 25.4 | Very low | 27.9 | Very low | 185 Ų | 185 | 147.8 Ų | 147.8 | 81% | 0.811 | 79% | 0.793 | S | S | * | * | cis | -141 | 144.5 | 27.9 | -113.5 | -130.3 | 0 | 0 | 0 | 108.8 | ||||
| 411 | E | 27.8 | Very low | 27.9 | Very low | 151 Ų | 151 | 150.1 Ų | 150.1 | 71% | 0.706 | 79% | 0.794 | S | S | * | * | 75.1 | 136.1 | 83.7 | -145.9 | 178.1 | 137.3 | 0 | 0 | 115.2 | |||||
| 412 | E | 27.5 | Very low | 27.8 | Very low | 178 Ų | 178 | 148 Ų | 148 | 83% | 0.832 | 80% | 0.796 | S | S | * | * | trans | -74 | 153.3 | -173.2 | -65.4 | 160 | 95 | 0 | 0 | 113.9 | ||||
| 413 | R | 25.2 | Very low | 27.8 | Very low | 238 Ų | 238 | 149.9 Ų | 149.9 | 90% | 0.898 | 81% | 0.806 | S | S | * | * | trans | -166.2 | 143.4 | 132.7 | -110 | 167 | -148.6 | -156.6 | 4.7 | 114.3 | ||||
| 414 | E | 27.9 | Very low | 27.6 | Very low | 178 Ų | 178 | 152.2 Ų | 152.2 | 83% | 0.832 | 81% | 0.807 | S | S | * | * | trans | -65.1 | 151.5 | 166.4 | -55.4 | 170.2 | 105.9 | 0 | 0 | 111.8 | ||||
| 415 | H | 28.3 | Very low | 27.6 | Very low | 193 Ų | 193 | 150.2 Ų | 150.2 | 89% | 0.894 | 80% | 0.797 | S | S | * | * | trans | 175.3 | 139.7 | 140.8 | -94.8 | 52.9 | 0 | 0 | 0 | 104.9 | ||||
| 416 | G | 24.3 | Very low | 27.6 | Very low | 63 Ų | 63 | 155.9 Ų | 155.9 | 65% | 0.649 | 80% | 0.798 | S | S | * | * | cis | 120.2 | 101.1 | 10.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 417 | H | 26.8 | Very low | 27.6 | Very low | 198 Ų | 198 | 148.9 Ų | 148.9 | 92% | 0.917 | 79% | 0.792 | S | S | * | * | trans | 65.7 | 156 | 173.1 | -76.8 | -43.6 | 0 | 0 | 0 | 117.6 | ||||
| 418 | A | 27.9 | Very low | 27.6 | Very low | 91 Ų | 91 | 147.9 Ų | 147.9 | 75% | 0.752 | 79% | 0.794 | S | S | * | * | cis | -164.1 | 176 | -8.9 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 419 | G | 27 | Very low | 27.6 | Very low | 69 Ų | 69 | 149.6 Ų | 149.6 | 71% | 0.711 | 79% | 0.789 | S | S | * | * | trans | 90.3 | 128.1 | 167.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 420 | A | 27.8 | Very low | 27.8 | Very low | 100 Ų | 100 | 154 Ų | 154 | 83% | 0.826 | 80% | 0.796 | S | S | * | * | cis | 58.4 | 131.4 | 39.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 421 | E | 28.7 | Very low | 28 | Very low | 184 Ų | 184 | 152 Ų | 152 | 86% | 0.86 | 80% | 0.799 | S | S | * | * | cis | -136.7 | 157 | 26.9 | -73.5 | 167.1 | 105.1 | 0 | 0 | 115.3 | ||||
| 422 | S | 25.5 | Very low | 28.1 | Very low | 102 Ų | 102 | 148.9 Ų | 148.9 | 71% | 0.713 | 80% | 0.799 | S | S | * | * | trans | -41.6 | 144.9 | 152.7 | 46.8 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 423 | L | 30.2 | Very low | 28 | Very low | 171 Ų | 171 | 146.2 Ų | 146.2 | 90% | 0.895 | 80% | 0.8 | S | S | * | * | -158.7 | 144.2 | 129.7 | -119.9 | 138 | 0 | 0 | 0 | 113 | |||||
| 424 | E | 29.5 | Very low | 28.2 | Very low | 171 Ų | 171 | 140.9 Ų | 140.9 | 80% | 0.799 | 79% | 0.794 | S | S | * | * | trans | -65.4 | 159.7 | 173.9 | -67.1 | 156.8 | 89.2 | 0 | 0 | 111 | ||||
| 425 | D | 28 | Very low | 28.2 | Very low | 121 Ų | 121 | 140.7 Ų | 140.7 | 65% | 0.647 | 79% | 0.793 | S | S | * | * | -171 | 167.8 | 67.2 | -168 | 25 | 0 | 0 | 0 | 114.2 | |||||
| 426 | R | 30.3 | Very low | 28.1 | Very low | 216 Ų | 216 | 137.8 Ų | 137.8 | 82% | 0.815 | 79% | 0.789 | S | S | * | * | trans | -16.2 | 123.8 | 170.1 | -68.3 | 151.6 | 179.3 | 164 | -3.3 | 119.9 | ||||
| 427 | G | 27.1 | Very low | 28.3 | Very low | 68 Ų | 68 | 140 Ų | 140 | 70% | 0.701 | 79% | 0.794 | S | S | * | * | 84.8 | 150.6 | 86.6 | 0 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 428 | K | 30.1 | Very low | 28.9 | Very low | 190 Ų | 190 | 135.8 Ų | 135.8 | 83% | 0.826 | 78% | 0.784 | S | S | * | * | trans | 71.8 | 143.6 | -177.9 | -64.8 | 168.7 | 176.8 | 168 | 0 | 113.8 | ||||
| 429 | R | 27.9 | Very low | 28.9 | Very low | 208 Ų | 208 | 138 Ų | 138 | 79% | 0.785 | 78% | 0.783 | S | S | * | * | cis | -156.7 | 145 | 7.1 | -137.8 | 172 | -62.9 | 179.2 | 2.7 | 109.9 | ||||
| 430 | D | 29.8 | Very low | 29 | Very low | 160 Ų | 160 | 143.6 Ų | 143.6 | 86% | 0.856 | 79% | 0.788 | S | S | * | * | trans | -66.6 | 139.5 | 165.1 | -54.1 | -81.3 | 0 | 0 | 0 | 111.5 | ||||
| 431 | V | 29.8 | Very low | 29.1 | Very low | 142 Ų | 142 | 142.5 Ų | 142.5 | 86% | 0.861 | 78% | 0.779 | S | S | * | * | trans | -142.6 | 132.1 | 153.9 | -178.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 432 | A | 30 | Very low | 29.1 | Very low | 85 Ų | 85 | 141.5 Ų | 141.5 | 70% | 0.702 | 78% | 0.779 | S | S | * | * | trans | -76.7 | 165.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 433 | S | 27 | Very low | 29.2 | Very low | 123 Ų | 123 | 146.3 Ų | 146.3 | 86% | 0.86 | 79% | 0.79 | S | S | * | * | 173.3 | 173.9 | 116.7 | 48.8 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 434 | T | 28.1 | Very low | 29 | Very low | 126 Ų | 126 | 143.2 Ų | 143.2 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | trans | -123.1 | 159.6 | -152 | -39.2 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 435 | Q | 28.4 | Very low | 28.9 | Very low | 174 Ų | 174 | 145.4 Ų | 145.4 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | trans | 101.8 | 155.3 | 150 | -63.9 | -160 | -15.5 | 0 | 0 | 120.9 | ||||
| 436 | V | 26.5 | Very low | 28.9 | Very low | 132 Ų | 132 | 147.9 Ų | 147.9 | 80% | 0.8 | 79% | 0.789 | S | S | * | * | trans | 98.6 | 107.4 | 156 | -165.6 | 0 | 0 | 0 | 0 | 117 | ||||
| 437 | S | 28.5 | Very low | 28.7 | Very low | 110 Ų | 110 | 144.9 Ų | 144.9 | 77% | 0.769 | 79% | 0.789 | S | S | * | * | trans | -91.6 | 162.9 | 157.7 | -43.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 438 | P | 38.8 | Very low | 28.6 | Very low | 109 Ų | 109 | 148.2 Ų | 148.2 | 71% | 0.708 | 80% | 0.8 | S | S | * | * | -156.3 | 164 | 93.5 | 38.1 | -18.2 | 0 | 0 | 0 | 118.5 | |||||
| 439 | L | 28.6 | Very low | 28.4 | Very low | 136 Ų | 136 | 147.5 Ų | 147.5 | 71% | 0.712 | 80% | 0.798 | S | S | * | * | trans | 21.8 | 132.2 | 139.3 | -62.6 | 149.7 | 0 | 0 | 0 | 119.4 | ||||
| 440 | F | 29.5 | Very low | 28.4 | Very low | 188 Ų | 188 | 144.1 Ų | 144.1 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | 178 | 175.1 | 63.6 | -97.1 | -49 | 0 | 0 | 0 | 109.2 | |||||
| 441 | A | 29.6 | Very low | 28.3 | Very low | 77 Ų | 77 | 144.1 Ų | 144.1 | 64% | 0.636 | 80% | 0.799 | S | S | * | * | cis | -166.6 | 162.3 | -15.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 442 | N | 27.9 | Very low | 28.6 | Very low | 163 Ų | 163 | 143.3 Ų | 143.3 | 87% | 0.872 | 80% | 0.797 | S | S | * | * | trans | 46.7 | 125.2 | 148.4 | -79 | -14.9 | 0 | 0 | 0 | 124.3 | ||||
| 443 | Q | 27.9 | Very low | 28.6 | Very low | 202 Ų | 202 | 148.3 Ų | 148.3 | 94% | 0.944 | 81% | 0.806 | S | S | * | * | trans | -146 | 150.9 | 130.7 | -144.2 | 169.4 | 22 | 0 | 0 | 111.1 | ||||
| 444 | S | 27.1 | Very low | 28.6 | Very low | 107 Ų | 107 | 154.3 Ų | 154.3 | 75% | 0.748 | 81% | 0.81 | S | S | * | * | trans | -131.9 | 144 | -168 | 167 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 445 | R | 26.7 | Very low | 29.2 | Very low | 217 Ų | 217 | 154.7 Ų | 154.7 | 82% | 0.819 | 81% | 0.811 | S | S | * | * | trans | -174.9 | 122.6 | 139.7 | -104.5 | 170.4 | -172.4 | -161.7 | 4.6 | 116 | ||||
| 446 | K | 27.7 | Very low | 30 | Very low | 172 Ų | 172 | 155.5 Ų | 155.5 | 75% | 0.748 | 84% | 0.836 | S | S | * | * | trans | 66.2 | 104.2 | 134.4 | -67.6 | 179.6 | 176.7 | -167.7 | 0 | 123 | ||||
| 447 | N | 25.5 | Very low | 30.2 | Very low | 153 Ų | 153 | 156.7 Ų | 156.7 | 82% | 0.818 | 84% | 0.838 | S | S | * | * | 36 | 129.4 | 123.9 | -57 | 13.8 | 0 | 0 | 0 | 122.4 | |||||
| 448 | C | 25.2 | Very low | 30.3 | Very low | 138 Ų | 138 | 159.2 Ų | 159.2 | 93% | 0.932 | 84% | 0.842 | S | S | * | * | -151.6 | 154.9 | 116.4 | -123.6 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 449 | F | 27 | Very low | 29.8 | Very low | 176 Ų | 176 | 161.9 Ų | 161.9 | 77% | 0.772 | 85% | 0.849 | S | S | * | * | trans | -113.8 | 151.4 | -162.8 | -135.3 | -89.9 | 0 | 0 | 0 | 111.9 | ||||
| 450 | C | 26.4 | Very low | 29.9 | Very low | 136 Ų | 136 | 163.5 Ų | 163.5 | 92% | 0.919 | 86% | 0.857 | S | S | * | * | trans | -169.2 | 124.4 | 146.8 | -99.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 451 | E | 28.5 | Very low | 29.9 | Very low | 160 Ų | 160 | 161.9 Ų | 161.9 | 75% | 0.748 | 86% | 0.859 | S | S | * | * | trans | -134 | 133.6 | 175.2 | -176.9 | 178.5 | 179.7 | 0 | 0 | 108 | ||||
| 452 | P | 35 | Very low | 30 | Very low | 125 Ų | 125 | 167.6 Ų | 167.6 | 81% | 0.812 | 87% | 0.874 | S | S | * | * | P | Polyproline II helix | trans | -87.8 | 126.3 | -174.9 | 32.2 | -32.4 | 0 | 0 | 0 | 112.8 | ||
| 453 | Q | 30.2 | Very low | 30.1 | Very low | 191 Ų | 191 | 167.9 Ų | 167.9 | 89% | 0.893 | 87% | 0.874 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 147.3 | 171.4 | -76.5 | -179 | -43.7 | 0 | 0 | 112.5 | ||
| 454 | R | 28.6 | Very low | 30.3 | Very low | 249 Ų | 249 | 165.3 Ų | 165.3 | 94% | 0.94 | 87% | 0.869 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 144.1 | 161.4 | -76.2 | -178.2 | -175.4 | 167.9 | 3.3 | 110.3 | ||
| 455 | V | 39.1 | Very low | 30.5 | Very low | 133 Ų | 133 | 170.2 Ų | 170.2 | 81% | 0.806 | 88% | 0.879 | S | S | * | * | trans | -104.7 | 130.3 | 163.2 | 177.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 456 | S | 46.7 | Very low | 30.9 | Very low | 192 Ų | 192 | 165.9 Ų | 165.9 | 100% | 1.343 | 89% | 0.885 | S | S | * | * | trans | 27.5 | 0 | 162.6 | -58.3 | 0 | 0 | 0 | 0 | 118.9 |
Retrieved 456 of 456 residues in 411.7 ms
(Link to these results)